SCHEMBL23880593

SCHEMBL23880593

COc1ccc(C#N)c(C#N)c1OC

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.52
▸ IMPDH2 P12268 1/20 0.52
▸ IMPDH1 P20839 1/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ USP2 O75604 1/20 0.52
▸ AR P10275 8/20 0.42
▸ MAOA P21397 3/20 0.41
▸ MAOB P27338 3/20 0.41
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ USP8 P40818 1/20 0.39
▸ USP7 Q93009 1/20 0.39

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
SCHEMBL15389432 0.88 ALDH1A1 (0.52) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL4696500 0.83 ALDH1A1 (0.55) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL8975491 0.81 IMPDH2 (0.50) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL14331580 0.80 GAA (0.42) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL10540003 0.80 ALDH1A1 (0.52) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL10757785 0.78 ALDH1A1 (0.46) ALDH1A1KDM4EUSP2LMNAMAPT
SCHEMBL21823716 0.78 LMNA (0.39) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL6954237 0.78 ALDH1A1 (0.50) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL5750458 0.78 ALDH1A1 (0.50) ALDH1A1IMPDH2IMPDH1KDM4EUSP2
SCHEMBL4077294 0.78 ALDH1A1 (0.50) ALDH1A1IMPDH2IMPDH1KDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113322057-B Adsorption inhibitor, preparation method and application thereof 中国石油化工股份有限公司 2022-05-24 — — CN claimed
US-12203883-B2 Conductive bimetallic metal-organic frameworks for the detection of analytes TRUSTEES OF DARTMOUTH COLLEGE (US) 2025-01-21 — — US disclosed
CN-113322057-B Adsorption inhibitor, preparation method and application thereof 中国石油化工股份有限公司 2022-05-24 — — CN disclosed
US-20210310971-A1 CONDUCTIVE BIMETALLIC METAL-ORGANIC FRAMEWORKS FOR THE DETECTION OF ANALYTES TRUSTEES OF DARTMOUTH COLLEGE (US) 2021-10-07 — — US disclosed
CN-100402499-C 2-iminopyrrolidine derivatives EISAI CO LTD (JP) 2008-07-16 — — CN disclosed
CN-1321996-C Process for producing 2-iminopyrrolidine derivative SANITATION STUFF R & D MANAGE (JP) 2007-06-20 — — CN disclosed
CN-1754880-A Process for preparing 2-iminopyrrolidine derivatives EISAI CO LTD (JP) 2006-04-05 — — CN disclosed
CN-1243735-C 2-iminopyrrolidine derivatives EISAI CO LTD (JP) 2006-03-01 — — CN disclosed
CN-1733725-A Process for preparing 2-iminopyrrolidine derivatives EISAI CO LTD (JP) 2006-02-15 — — CN disclosed
CN-1503784-A 2-iminopyrrolidine derivatives ������������ʽ���� 2004-06-09 — — CN disclosed
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