SCHEMBL9145390

SCHEMBL9145390

NC1=CC(=O)CC=C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL7887724 0.72 GSK3A (0.33)
SCHEMBL2553004 0.70
SCHEMBL5323960 0.69
SCHEMBL13657618 0.68
SCHEMBL11767073 0.68
SCHEMBL13870990 0.68
SCHEMBL14844717 0.68
SCHEMBL7434231 0.67
SCHEMBL10869936 0.67
SCHEMBL1434528 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0065733-B1 PROCESS FOR PREPARING 3-ALKYLAMINOPHENOLS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-11 EP claimed
EP-0065733-A1 Process for preparing 3-alkylaminophenols HOECHST AKTIENGESELLSCHAFT (DE) 1982-12-01 EP claimed
CN-110621664-B Novel piperidine-2, 6-dione derivatives and uses thereof 韩国化学研究院 2023-08-01 CN disclosed
US-20150168387-A1 COLOR-PRODUING DIAGNOSTIC SYSTEMS, REAGENTS AND METHODS DIAGNOSTIC INNOVATIONS, LLC 2015-06-18 US disclosed
US-8815532-B2 Color-producing diagnostic systems, reagents and methods DIAGNOSTIC INNOVATIONS, LLC (US) 2014-08-26 US disclosed
EP-2718348-A2 COLOR-PRODUCING DIAGNOSTIC SYSTEMS, REAGENTS AND METHODS Diagnostic Innovations, LLC (US) 2014-04-16 EP disclosed
US-20130023444-A1 COLOR-PRODUCING DIAGNOSTIC SYSTEMS, REAGENTS AND METHODS DIAGNOSTIC INNOVATIONS, LLC (US) 2013-01-24 US disclosed
WO-2012170206-A2 COLOR-PRODUCING DIAGNOSTIC SYSTEMS, REAGENTS AND METHODS DIAGNOSTIC INNOVATIONS, LLC (US) 2012-12-13 WO disclosed
US-5409780-A 3-oxy-N-(functionalized alkyl) anilines covalently bonded to bibulous strips through functional groups; quantitative analysis, accuracy CHEMTRAK, INC. (US) 1995-04-25 US disclosed
US-5409780-A 3-oxy-N-(functionalized alkyl) anilines covalently bonded to bibulous strips through functional groups; quantitative analysis, accuracy CHEMTRAK, INC. (US) 1995-04-25 US disclosed
EP-0065733-B1 PROCESS FOR PREPARING 3-ALKYLAMINOPHENOLS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-11 EP disclosed
US-4042322-A CATIONIC DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-08-16 US disclosed
US-3980430-A CATIONIC DYE, HALOGENATED HYDROCARBON BAYER AKTIENGESELLSCHAFT (DT) 1976-09-14 US disclosed