SCHEMBL19686889

SCHEMBL19686889

CNC(C)(CCCNC(=N)N)C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALB P02768 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
PAOX Q6QHF9 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14898394 1.00 ALOX15 (0.36) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL25908987 0.95 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL9114925 0.87 ALOX15 (0.36) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL24305739 0.86 MEN1 (0.37) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL25908972 0.86 KDM4E (0.33) KDM4EMAPK1HIF1APAOX
SCHEMBL20857570 0.84
SCHEMBL10078923 0.79 ALOX15 (0.38) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL6424463 0.77 ALOX15 (0.36) ALOX15MEN1CYP1A2KMT2ASMN1; SMN2
SCHEMBL20878389 0.75
SCHEMBL25908989 0.74 KDM1A (0.50)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230119612-A1 PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. 2023-04-20 US disclosed
EP-3052121-B1 WNT COMPOSITIONS AND METHODS FOR PURIFICATION UNIV LELAND STANFORD JUNIOR (US) 2023-02-22 EP disclosed
US-20230037284-A9 COMBINATION THERAPY OF PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. 2023-02-02 US disclosed
US-20220000968-A1 PEPTIDOMIMETIC MACROCYCLES HOFFMAN-LA ROCHE, INC. 2022-01-06 US disclosed
US-20210363189-A1 COMBINATION THERAPY OF PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS INC (US) 2021-11-25 US disclosed
US-20210299211-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF AILERON THERAPEUTICS, INC. 2021-09-30 US disclosed
US-11091522-B2 Peptidomimetic macrocycles and uses thereof AILERON THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-11008366-B2 Peptidomimetic macrocycles AILERON THERAPEUTICS, INC. (US) 2021-05-18 US disclosed
US-10967042-B2 Peptidomimetic macrocycles AILERON THERAPEUTICS, INC. (US) 2021-04-06 US disclosed
US-10905739-B2 Peptidomimetic macrocycles and formulations thereof AILERON THERAPEUTICS, INC. (US) 2021-02-02 US disclosed
US-20190256559-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF AILERON THERAPEUTICS, INC. 2019-08-22 US disclosed
US-20190225650-A1 PEPTIDOMIMETIC MACROCYCLES AND USE THEREOF IN REGULATING HIF1ALPHA AILERON THERAPEUTICS, INC. 2019-07-25 US disclosed
US-20190185518-A9 WARHEAD-CONTAINING PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF BFL-1 AILERON THERAPEUTICS, INC. 2019-06-20 US disclosed
US-10308699-B2 Peptidomimetic macrocycles AILERON THERAPEUTICS, INC. (US) 2019-06-04 US disclosed
US-10227380-B2 Triazole-crosslinked and thioether-crosslinked peptidomimetic macrocycles AILERON THERAPEUTICS, INC. (US) 2019-03-12 US disclosed
US-10023613-B2 Peptidomimetic macrocycles as modulators of MCL-1 AILERON THERAPEUTICS, INC. (US) 2018-07-17 US disclosed
US-20180193264-A1 WNT COMPOSITIONS AND METHODS FOR PURIFICATION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2018-07-12 US disclosed
US-9957299-B2 Peptidomimetic macrocycles AILERON THERAPEUTICS, INC. (US) 2018-05-01 US disclosed
US-9937126-B2 Wnt compositions and methods for purification THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-04-10 US disclosed
US-20170349638-A1 COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES AILERON THERAPEUTICS, INC. 2017-12-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (17 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190225650-A1 PEPTIDOMIMETIC MACROCYCLES AND USE THEREOF IN REGULATING HIF1ALPHA HIF1A, HIF1AN, EGLN3 ALOX15 4192/4885MEN1 1503/4885CYP1A2 3301/4885
US-10023613-B2 Peptidomimetic macrocycles as modulators of MCL-1 MCL1, BCL2L1, BCL2L11 ALOX15 3670/4885MEN1 1135/4885CYP1A2 4470/4885
US-10308699-B2 Peptidomimetic macrocycles GHRHR, GHSR, GHITM ALOX15 4018/4885MEN1 89/4885CYP1A2 4349/4885
US-20230119612-A1 PEPTIDOMIMETIC MACROCYCLES TP53, MDM2, MDM4 ALOX15 4436/4885MEN1 250/4885CYP1A2 4694/4885
US-10905739-B2 Peptidomimetic macrocycles and formulations thereof MDM2, TP53, TP53BP1 ALOX15 4003/4885MEN1 567/4885CYP1A2 4431/4885
US-20170349638-A1 COMPANION DIAGNOSTIC TOOL FOR PEPTIDOMIMETIC MACROCYCLES TP53, TP53BP1, VHL ALOX15 4769/4885MEN1 585/4885CYP1A2 4396/4885
US-20230037284-A9 COMBINATION THERAPY OF PEPTIDOMIMETIC MACROCYCLES BID, FLT3, GRPR ALOX15 4124/4885MEN1 356/4885CYP1A2 4241/4885
US-20190185518-A9 WARHEAD-CONTAINING PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF BFL-1 BCL2L11, BCL2L1, BCL2L13 ALOX15 4210/4885MEN1 1644/4885CYP1A2 4378/4885
US-20210299211-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF MDM2, TP53, TP53BP1 ALOX15 4003/4885MEN1 567/4885CYP1A2 4431/4885
US-10227380-B2 Triazole-crosslinked and thioether-crosslinked peptidomimetic macrocycles IL33, TPR, CDC37 ALOX15 2725/4885MEN1 1768/4885CYP1A2 2855/4885
US-20190256559-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF TP53, TP53BP1, MDM2 ALOX15 4370/4885MEN1 1408/4885CYP1A2 3204/4885
US-11091522-B2 Peptidomimetic macrocycles and uses thereof FLT3, BID, GRPR ALOX15 3714/4885MEN1 376/4885CYP1A2 4151/4885
US-11008366-B2 Peptidomimetic macrocycles GLP1R, PROKR1, VIP ALOX15 3864/4885MEN1 219/4885CYP1A2 4311/4885
US-20220000968-A1 PEPTIDOMIMETIC MACROCYCLES TP53, MDM2, MDM4 ALOX15 4436/4885MEN1 250/4885CYP1A2 4694/4885
US-10967042-B2 Peptidomimetic macrocycles TP53, MDM2, MDM4 ALOX15 4436/4885MEN1 250/4885CYP1A2 4694/4885
US-20180193264-A1 WNT COMPOSITIONS AND METHODS FOR PURIFICATION WNT3A, CTNNBL1, WNT1 ALOX15 2110/4885MEN1 3024/4885CYP1A2 4859/4885
US-20210363189-A1 COMBINATION THERAPY OF PEPTIDOMIMETIC MACROCYCLES BID, FLT3, GRPR ALOX15 4124/4885MEN1 356/4885CYP1A2 4241/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.