SCHEMBL96239

SCHEMBL96239

OCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.54
IDO1 P14902 4/20 0.52
KIF11 P52732 3/20 0.47
MAOB P27338 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
ORAI1 Q96D31 1/20 0.46
ORAI2 Q96SN7 1/20 0.46
ORAI3 Q9BRQ5 1/20 0.46
TRPV6 Q9H1D0 1/20 0.46
MGLL Q99685 1/20 0.46
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
SRD5A2 P31213 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45

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
Hydrochloric Acid SCHEMBL30282379 0.97 IDO1 (0.54) TAAR1IDO1KIF11MAOBCES2
Hydroxyamine SCHEMBL9048789 0.95 TAAR1 (0.56) TAAR1IDO1KIF11MAOBCES2
SCHEMBL15437156 0.93 TAAR1 (0.59) TAAR1IDO1MAOB
SCHEMBL1781036 0.93 KIF11 (0.58) TAAR1IDO1KIF11MAOBPSEN1
SCHEMBL5509990 0.93 SRD5A2 (0.55) TAAR1IDO1KIF11MAOBCES2
SCHEMBL28109891 0.91 TAAR1 (0.47) TAAR1IDO1KIF11MAOBCES2
Phosphoric Acid SCHEMBL28852148 0.89 PTPN2 (0.47) TAAR1IDO1CES2CES1PSEN1
SCHEMBL6250682 0.87 IDO1 (0.46) TAAR1IDO1KIF11MAOBPSEN1
SCHEMBL1451054 0.87 LTA4H (0.59) TAAR1IDO1MAOBKMT2A
SCHEMBL12619997 0.87 TAAR1 (0.44) TAAR1IDO1KIF11MAOBCES2

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 2209 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122011050-A 2N-type cobalt complex, preparation method thereof and hydrosilylating reaction of hydrosilane and alcohol 石河子大学 2026-05-12 CN claimed
CN-119678944-A High-stability pyraclostrobin suspending agent and preparation method thereof 石家庄市深泰化工有限公司 2025-03-25 CN claimed
CN-119119906-A High-stability UV (ultraviolet) adhesive-reducing tape and preparation method thereof 安徽明讯新材料科技股份有限公司 2024-12-13 CN claimed
CN-118994765-A Insulation and pressure-resistant material for cable 安徽朗达电线电缆有限公司 2024-11-22 CN claimed
CN-118772397-A Synthesis method of poly-L-alanine with high polymerization degree 安徽华恒生物科技股份有限公司 2024-10-15 CN claimed
CN-118724845-A Method for preparing ether derivatives by low-cost metal catalysis 哈尔滨工业大学(深圳)(哈尔滨工业大学深圳科技创新研究院) 2024-10-01 CN claimed
CN-115369432-B Method for preparing nitrile by electrocatalytic coupling of primary alcohol and ammonia substance 大连理工大学 2024-08-20 CN claimed
CN-113559904-B Application of nitrogen-carbon material anchored iron single-atom catalyst in catalyzing ammoxidation of alcohol to prepare nitrile 南京理工大学 2024-04-02 CN claimed
CN-117476989-A Proton exchange membrane with hydrophilic-hydrophobic structure, and preparation method and application thereof 东莞市大擎氢能科技有限公司 2024-01-30 CN claimed
CN-114717571-B Anolyte and benzaldehyde and hydrogen coupling co-production system and application 东北师范大学 2023-11-24 CN claimed
WO-2000018724-A1 (R)-CHIRAL HALOGENATED 1-SUBSTITUTEDAMINO-(n+1)-ALKANOLS USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO claimed
WO-2000018723-A1 SUBSTITUTED N-ALIPHATIC-N-AROMATIC TERTIARY-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO claimed
EP-0973767-A1 INDAZOLES OF CYCLIC UREAS USEFUL AS HIV PROTEASE INHIBITORS Dupont Pharmaceuticals Company (US) 2000-01-26 EP claimed
US-5985867-A TREATING HIV INFECTION DUPONT PHARMACEUTICALS COMPANY (US) 1999-11-16 US claimed
CN-1041922-C Heterocyclic compounds ZENECA LTD (GB) 1999-02-03 CN claimed
WO-1998043969-A1 INDAZOLES OF CYCLIC UREAS USEFUL AS HIV PROTEASE INHIBITORS DUPONT PHARMACEUTICALS COMPANY (US) 1998-10-08 WO claimed
CN-1039415-C Heterocyclic compounds ZENECA LTD (GB) 1998-08-05 CN claimed
CN-1098718-A Heterogeneous ring compound ZENECA LTD (GB) 1995-02-15 CN claimed
CN-1094400-A Heterogeneous ring compound ZENECA LTD (GB) 1994-11-02 CN claimed
EP-0147052-A2 Rodenticides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-07-03 EP claimed