SCHEMBL6971648

SCHEMBL6971648

CC(=O)Nc1cnn(C)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
L3MBTL1 Q9Y468 2/20 0.64
ALDH1A1 P00352 1/20 0.64
EPHX2 P34913 1/20 0.53
MAOA P21397 1/20 0.49
CCNC P24863 3/20 0.46
CDK8 P49336 3/20 0.46
EGFR P00533 2/20 0.46
FGFR1 P11362 2/20 0.46
KDR P35968 2/20 0.46
KDM1A O60341 2/20 0.45
CREBBP Q92793 1/20 0.45
PIK3CG P48736 1/20 0.44
FSCN1 Q16658 1/20 0.42
NAMPT P43490 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PIM1 P11309 1/20 0.41
PIM3 Q86V86 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL29505602 0.88 L3MBTL1 (0.53) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL4730942 0.84 ALDH1A1 (0.64) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL3937642 0.82 ALDH1A1 (0.62) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL2632921 0.81 ALDH1A1 (0.60) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL24806495 0.80 ALDH1A1 (0.54) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL19699489 0.79 ALDH1A1 (0.58) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL25020926 0.79 ALDH1A1 (0.73) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2
SCHEMBL6971646 0.78 HIF1A (0.41) HTTSMN1; SMN2L3MBTL1ALDH1A1NAPRT
SCHEMBL16650077 0.78 SMN1; SMN2 (0.41) HTTSMN1; SMN2L3MBTL1ALDH1A1NAPRT
SCHEMBL25188076 0.78 HTT (0.57) HTTSMN1; SMN2L3MBTL1ALDH1A1EPHX2

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
CN-111526877-B Compounds and compositions for IRE1 inhibition 奥普提卡拉公司 2023-08-25 CN claimed
EP-3675858-B1 IMIDAZO[1,5-A]PYRAZINE COMPOUNDS AND COMPOSITIONS FOR IRE1 INHIBITION OPTIKIRA LLC (US) 2023-04-26 EP claimed
EP-2678342-A1 N-SUBSTITUTED OXAZINOPTERIDINES AND OXAZINOPTERIDINONES Takeda Pharmaceutical Company Limited (JP) 2014-01-01 EP claimed
WO-2012148548-A1 N-SUBSTITUTED OXAZINOPTERIDINES AND OXAZINOPTERIDINONES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-01 WO claimed
US-20250270209-A1 LRRK2 INHIBITORS INTERLINE THERAPEUTICS, INC. 2025-08-28 US disclosed
EP-4400497-A1 3CLPRO PROTEASE INHIBITOR Shanghai Qilu Pharmaceutical Research and Development Centre Ltd. (CN) 2024-07-17 EP disclosed
WO-2024073745-A1 INHIBITORS OF EGFR OR HER2 AND METHODS OF USE ARBELLA THERAPEUTICS, LLC (US) 2024-04-04 WO disclosed
WO-2023224963-A1 DUAL-ACTING ANGIOTENSIN AND ENDOTHELIN RECEPTOR ANTAGONISTS ARIA PHARMACEUTICALS, INC. (US) 2023-11-23 WO disclosed
WO-2023215367-A1 BICYCLIC PIPERAZINONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. (US) 2023-11-09 WO disclosed
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2023-09-07 US disclosed
CN-111526877-B Compounds and compositions for IRE1 inhibition 奥普提卡拉公司 2023-08-25 CN disclosed
US-20230265101-A1 Preparation Of A Pyrimidinyl-3,8-Diazabicyclo[3.2.1]Octanylmethanone Derivative And Salt Thereof PFIZER INC. (US) 2023-08-24 US disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 WO disclosed
US-20170362234-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-21 US disclosed
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 US disclosed
US-9365574-B2 Soluble guanylate cyclase activators MERCK SHARP & DOHME CORP. (US) 2016-06-14 US disclosed
EP-2575473-B1 SOLUBLE GUANYLATE CYCLASE ACTIVATORS MERCK SHARP & DOHME (US) 2016-01-20 EP disclosed
US-7175976-B2 Silver halide photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 2007-02-13 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP 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 (5 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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 HTT 420/4885SMN1; SMN2 2016/4885L3MBTL1 3355/4885
US-20230278989-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM MDM2, TP53, TP53BP1 HTT 351/4885SMN1; SMN2 4132/4885L3MBTL1 1473/4885
US-20170362234-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 HTT 365/4885SMN1; SMN2 1917/4885L3MBTL1 3276/4885
US-20230265101-A1 Preparation Of A Pyrimidinyl-3,8-Diazabicyclo[3.2.1]Octanylmethanone Derivative And Salt Thereof OR10J3, ODC1, DHPS HTT 3390/4885SMN1; SMN2 1498/4885L3MBTL1 4694/4885
US-20250270209-A1 LRRK2 INHIBITORS LRRK2, PARK7, PINK1 HTT 259/4885SMN1; SMN2 766/4885L3MBTL1 1845/4885

“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.