SCHEMBL82833

SCHEMBL82833

COc1cc(N)c(C#N)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 2/20 0.55
USP2 O75604 1/20 0.55
NPC1 O15118 1/20 0.42
IMPDH2 P12268 1/20 0.41
IMPDH1 P20839 1/20 0.41
MAPKAPK2 P49137 1/20 0.41
AR P10275 5/20 0.40
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
EGFR P00533 1/20 0.39
ERBB2 P04626 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 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
SCHEMBL5326209 0.86 ALDH1A1 (0.50) ALDH1A1KDM4EUSP2IMPDH2IMPDH1
SCHEMBL8777864 0.85 ALDH1A1 (0.58) ALDH1A1KDM4EUSP2IMPDH2IMPDH1
SCHEMBL5652331 0.85 SRC (0.46) ALDH1A1KDM4EUSP2AREGFR
SCHEMBL20866202 0.85 SRC (0.46) ALDH1A1KDM4EUSP2AREGFR
SCHEMBL16664689 0.84 ALDH1A1 (0.49) ALDH1A1KDM4EUSP2IMPDH2IMPDH1
SCHEMBL31716249 0.84 ALDH1A1 (0.49) ALDH1A1KDM4EUSP2IMPDH2IMPDH1
SCHEMBL21996461 0.84 ALDH1A1 (0.49) ALDH1A1KDM4EUSP2NPC1IMPDH2
SCHEMBL28902119 0.84 POLB (0.52) ALDH1A1KDM4EUSP2IMPDH2IMPDH1
SCHEMBL13720176 0.84 KDM4E (0.49) ALDH1A1KDM4EUSP2NPC1IMPDH2
SCHEMBL11153594 0.84 NPC1 (0.60) ALDH1A1KDM4EUSP2NPC1IMPDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119176746-B Method for preparing bisphenol A and heterocyclic compound by using waste PC 浙江大学 2025-05-30 CN claimed
CN-119176746-A Method for preparing bisphenol A and heterocyclic compound by using waste PC 浙江大学 2024-12-24 CN claimed
CN-118440013-A Preparation method of quinazoline diketone compound 安顺学院 2024-08-06 CN claimed
CN-114380718-B Acylation method of aniline compound 河南农业大学 2022-09-30 CN claimed
CN-114380718-A Acylation method of aniline compound 河南农业大学 2022-04-22 CN claimed
CN-106946800-B A kind of synthetic method of -2,4 (1H, 3H)-diketone of quinazoline and its derivative 华东师范大学 2019-11-15 CN claimed
CN-106946800-A A kind of synthetic method of (1H, the 3H) diketone of quinazoline 2,4 and its derivative 华东师范大学 2017-07-14 CN claimed
CN-104059075-B 8,9-is mono-, disubstituted imidazoles [1,2-c]-quinazoline-3 (2H)-one fused heterocyclic compound and preparation method thereof ZAOZHUANG UNIVERSITY (CN) 2015-10-21 CN claimed
CN-101747323-B Method for preparing alfuzosin hydrochloride BEIJING INST TECHNOLOGY 2013-04-17 CN claimed
CN-101747323-A Method for preparing alfuzosin hydrochloride BEIJING INST TECHNOLOGY 2010-06-23 CN claimed
US-6336963-B1 INK COMPOSITION COMPRISING INK VEHICLE COMPRISING FIRST NITRILE COMPOUND HAVING FIRST VISCOSITY AT MELT TEMPERATURE, VISCOSITY MODIFIER COMPRISING SECOND NITRILE COMPOUND HAVING LOWER VISCOSITY AT MELT TEMPERATURE, COLORANT XEROX CORPORATION 2002-01-08 US claimed
EP-0308059-B1 1,2,3,4-TETRAHYDROISOQUINOLINE ANTIARRHYTHMIC AGENTS Pfizer Limited (GB) 1992-09-09 EP claimed
EP-0308059-A1 1,2,3,4-Tetrahydroisoquinoline antiarrhythmic agents Pfizer Limited (GB) 1989-03-22 EP claimed
WO-2025227032-A1 METHODS FOR DEGRADATION OF CYCLIN K AND INHIBITION OF CYCLIN DEPENDENT KINASES REMIX THERAPEUTICS INC. (US) 2025-10-30 WO disclosed
CN-120665049-A Convenient synthetic method of bunazosin 昭通学院 2025-09-19 CN disclosed
CN-119176746-B Method for preparing bisphenol A and heterocyclic compound by using waste PC 浙江大学 2025-05-30 CN disclosed
US-4060615-A ANTIHYPERTENSIVE, PHOSPHODIESTERASE INHIBITOR MEAD JOHNSON & COMPANY (US) 1977-11-29 US disclosed
US-4001269-A 3-AMINO-5,6-DIMETHOXYINDAZOLE HYDROCHLORIDE MORTON-NORWICH PRODUCTS, INC. (US) 1977-01-04 US disclosed
US-3980650-A 4-Amino-pyrimidine derivatives N.V. KONINKLIJKE PHARMACEUTISCHE FABRIEKEN V/H BROCADES-STHEEMAN EN PHARMACIA (NL) 1976-09-14 US disclosed
US-3935213-A Process for hypotensive 4-amino-2-(piperazin-1-yl) quinazoline derivatives PFIZER INC. (US) 1976-01-27 US disclosed