SCHEMBL144308

SCHEMBL144308

COc1ccc(C)cc1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.68
ALDH1A1 P00352 2/20 0.60
CYP3A4 P08684 1/20 0.60
GAA P10253 3/20 0.49
L3MBTL1 Q9Y468 4/20 0.46
MAPT P10636 5/20 0.46
KMT2A Q03164 3/20 0.46
USP2 O75604 2/20 0.46
MAPK1 P28482 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
ALOX15 P16050 1/20 0.44
TDP1 Q9NUW8 2/20 0.44

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
SCHEMBL29352952 1.00 ACHE (0.68) ACHEALDH1A1CYP3A4GAAL3MBTL1
Ammonia Solution, Strong SCHEMBL6473680 0.97 ACHE (0.65) ACHEALDH1A1CYP3A4GAAL3MBTL1
SCHEMBL29216678 0.91 ACHE (0.64) ACHEALDH1A1CYP3A4GAAL3MBTL1
SCHEMBL2151072 0.91 ACHE (0.58) ACHEALDH1A1CYP3A4GAAL3MBTL1
Anisole SCHEMBL28129062 0.85 CA4 (0.54) ACHEALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL22199044 0.85 ACHE (0.52) ACHEALDH1A1CYP3A4GAAL3MBTL1
Anisole SCHEMBL17144709 0.85 CA4 (0.54) ACHEALDH1A1CYP3A4L3MBTL1MAPT
SCHEMBL29225650 0.84 ACHE (0.50) ACHEALDH1A1CYP3A4GAAL3MBTL1
SCHEMBL8338270 0.81 ACHE (0.52) ACHEALDH1A1CYP3A4GAAMAPT
SCHEMBL4950654 0.81 HTR1A (0.50) ACHEALDH1A1CYP3A4GAAL3MBTL1

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

Appears in 2823 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005567-A Additive for active layer of organic solar cell and composition thereof 广州追光科技有限公司 2024-05-10 CN claimed
CN-114164435-B Method for preparing alpha-aluminum trihydride by electrochemical catalysis 北京珺政慧通科技有限公司 2023-03-14 CN claimed
CN-114164435-A Method for preparing alpha-aluminum trihydride by electrochemical catalysis 北京珺政慧通科技有限公司 2022-03-11 CN claimed
US-11069856-B2 Solution for organic EL, method of producing organic EL device and organic EL device JOLED INC. (JP) 2021-07-20 US claimed
CN-109516923-A Compounds and organic luminescent device comprising it 东进世美肯株式会社 2019-03-26 CN claimed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US claimed
EP-1891180-B1 ORGANIC SEMICONDUCTOR SOLUTIONS MERCK PATENT GMBH (DE) 2018-08-29 EP claimed
US-9805838-B2 Organic semiconductor formulation MERCK PATENT GMBH (DE) 2017-10-31 US claimed
EP-1716604-B1 SOLUTIONS OF ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2017-07-26 EP claimed
CN-103748703-B organic semiconductor formulation 默克专利股份有限公司 2017-07-21 CN claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2002020447-A1 METHOD OF PRODUCING FLUORINATED AND CHLORINATED BENZALDEHYDES AND COMPOSITIONS THEREOF MILLIKEN & COMPANY (US) 2002-03-14 WO claimed
EP-1147079-A2 BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS Bayer Aktiengesellschaft (DE) 2001-10-24 EP claimed
US-6300525-B1 CONTACTING SUBSTITUTED BENZENE IN CARBON MONOXIDE ATMOSPHERE HAVING SPECIFIED PRESSURE IN PRESENCE OF METAL HALIDE AND HYDROHALIC ACID CATALYST AND AT SPECIFIED TEMPERATURE MILLIKEN & COMPANY 2001-10-09 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
WO-2000041469-A2 β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2000-07-20 WO claimed
US-4707161-A Lightfastness of dyeings obtained with acid dyes or metal complex dyes on polyamides: treatment with copper hydroxamates BASF AKTIENGESELLSCHAFT (DE) 1987-11-17 US claimed
US-4493904-A COORDINATION, POLYMERIZATION CATALYST CONTAINING TITANIUM TRICHORI CONOCO INC. (US) 1985-01-15 US claimed
US-4473713-A Hydrolysis of aryl-aliphatic ethers RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1984-09-25 US claimed