SCHEMBL9927174

SCHEMBL9927174

CC[C@@H](CO)Nc1nc(NCc2ccc(-c3ccccn3)cc2)c2ncn(C(C)C)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 12/20 1.00
CCNK O75909 9/20 1.00
CDK12 Q9NYV4 9/20 1.00
CDK9 P50750 8/20 1.00
CCNE1 P24864 8/20 1.00
CDK1 P06493 8/20 1.00
CDK7 P50613 6/20 1.00
CCNA2 P20248 6/20 1.00
CDK5 Q00535 6/20 1.00
DYRK1A Q13627 6/20 1.00
CCNB1 P14635 5/20 1.00
CCNT1 O60563 5/20 1.00
CDK4 P11802 4/20 1.00
CCND1 P24385 4/20 1.00
CCNH P51946 4/20 1.00
CDK5R1 Q15078 4/20 1.00
MNAT1 P51948 2/20 1.00
CCNA1 P78396 5/20 0.82
CCNE2 O96020 2/20 0.82
MAPK1 P28482 3/20 0.79

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
SCHEMBL13001905 1.00 CDK2 (1.00) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL29644968 1.00 CDK2 (1.00) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL13001902 1.00 CDK2 (1.00) CDK2CCNKCDK12CDK9CCNE1
Hydrochloric Acid SCHEMBL21177798 0.99 CDK2 (0.98) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL3690866 0.96 CDK2 (0.92) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL20383014 0.91 CDK2 (0.83) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL19705772 0.91 CDK2 (0.83) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL23683123 0.91 CDK5 (0.82) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL17628573 0.90 CDK2 (1.00) CDK2CCNKCDK12CDK9CCNE1
SCHEMBL13001898 0.90 CDK2 (1.00) CDK2CCNKCDK12CDK9CCNE1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 US disclosed
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-02-16 US disclosed
EP-3749670-B1 5-ALKYLTHIO-7-[(4-ARYLBENZYL)AMINO]-1(2)H-PYRAZOLO[4,3-D]PYRIMIDINES FOR TREATMENT OF LYMPHOMA UNIV PALACKEHO (CZ) 2021-10-06 EP disclosed
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 US disclosed
US-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-09-16 US disclosed
US-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-08-05 US disclosed
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2021-07-29 US disclosed
US-10882863-B2 Compounds for reducing c-Myc in c-Myc overexpressing cancers background THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-01-05 US disclosed
EP-3749670-A1 5-ALKYLTHIO-7-[(4-ARYLBENZYL)AMINO]-1(2)H-PYRAZOLO[4,3-D]PYRIMIDINES FOR TREATMENT OF LYMPHOMA Univerzita Palackeho v Olomouci (CZ) 2020-12-16 EP disclosed
WO-2019149295-A1 5-ALKYLTHIO-7-[(4-ARYLBENZYL)AMINO]-1(2)H-PYRAZOLO[4,3-D]PYRIMIDINES FOR TREATMENT OF LYMPHOMA UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2019-08-08 WO disclosed
EP-2187889-B1 USE OF PURINE DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT CENTRE NAT RECH SCIENT (FR) 2013-11-06 EP disclosed
US-8431583-B2 Use of purine derivatives for the manufacture of a medicament CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-04-30 US disclosed
US-8431583-B2 Use of purine derivatives for the manufacture of a medicament CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-04-30 US disclosed
US-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH GEORGE MASON UNIVERSITY 2012-06-14 US disclosed
US-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH GEORGE MASON UNIVERSITY 2012-06-14 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 (8 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-20210238226-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ATXN2L, ATXN2, ATXN10 CDK2 2103/4885CCNK 1807/4885CDK12 2122/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 CDK2 1489/4885CCNK 2881/4885CDK12 1663/4885
US-20210283265-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 CDK2 1489/4885CCNK 2881/4885CDK12 1663/4885
US-20230050819-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE CYFIP2, TPX2, ATXN2 CDK2 1540/4885CCNK 4146/4885CDK12 1406/4885
US-20120149708-A1 MODULATORS OF VIRAL TRANSCRIPTION, AND METHODS AND COMPOSITIONS THEREWITH CDK2, CCNA1, CDK1 CDK2 1/4885CCNK 14/4885CDK12 55/4885
US-20210228723-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE ZFX, F13B, GRN CDK2 1981/4885CCNK 3185/4885CDK12 1562/4885
US-10882863-B2 Compounds for reducing c-Myc in c-Myc overexpressing cancers background MYC, MYCBP, BCOR CDK2 76/4885CCNK 50/4885CDK12 191/4885
US-20210284629-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, UBQLN2, UBTF CDK2 2992/4885CCNK 3719/4885CDK12 3230/4885

“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.