SCHEMBL232986

SCHEMBL232986

CC(=O)c1ccc(N2CCNCC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
USP2 O75604 1/20 0.65
TSHR P16473 1/20 0.65
HSD17B10 Q99714 1/20 0.65
ADRB1 P08588 4/20 0.58
MAPT P10636 3/20 0.57
KMT2A Q03164 3/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
HTR3E A5X5Y0 3/20 0.53
HTR3B O95264 3/20 0.53
HTR3A P46098 3/20 0.53
HTR3D Q70Z44 3/20 0.53
HTR3C Q8WXA8 3/20 0.53
SIGMAR1 Q99720 3/20 0.53
MEN1 O00255 2/20 0.53
OPRD1 P41143 1/20 0.53
MAOB P27338 1/20 0.52
ATM Q13315 1/20 0.51
ACVR1 Q04771 1/20 0.51

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
SCHEMBL6094124 1.00 ALDH1A1 (0.65) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL5234585 0.93 ALDH1A1 (0.58) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL20916938 0.89 ALDH1A1 (0.53) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL17669252 0.86 MAPT (0.71) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL15801114 0.86 MAPT (0.71) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL2427902 0.85 ALDH1A1 (0.86) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL4977907 0.84 HTR3E (0.59) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL598515 0.83 ALDH1A1 (0.72) ALDH1A1USP2TSHRHSD17B10ADRB1
SCHEMBL15156349 0.82 MAPT (0.62) ALDH1A1TSHRHSD17B10MAPTKMT2A
SCHEMBL909633 0.82 MAPT (0.62) ALDH1A1TSHRHSD17B10MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504687-A Piperazine coumarin derivative and synthetic method and application thereof 忻州师范学院 2025-02-25 CN claimed
CN-112939963-B Benzopyranoate derivative and synthesis method and application thereof 山西大学 2022-09-23 CN claimed
CN-112939963-A Benzopyranoic acid ester derivative and synthesis method and application thereof 山西大学 2021-06-11 CN claimed
CN-111253379-A Detect SO2Ratiometric fluorescent probes, their synthesis and use 济南大学 2020-06-09 CN claimed
CN-111253356-A Coumarin-benzopyrylium salt derivative and synthesis method and application thereof 山西大学 2020-06-09 CN claimed
EP-1831206-B1 N-SUBSTITUTED BENZIMIDAZOLYL C-KIT INHIBITORS AND COMBINATORIAL BENZIMIDAZOLE LIBRARY OSI PHARM INC (US) 2011-08-24 EP claimed
EP-1180991-B1 GAMBOGIC ACID DERIVATIVES AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA INC (US) 2010-05-19 EP claimed
CN-100505364-C Dynamic molecular electronic component and its operating method UNIV FUDAN (CN) 2009-06-24 CN claimed
JP-2008521903-A 2008-06-26 JP claimed
EP-1592426-B1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2007-12-19 EP claimed
WO-1996022297-A1 NON-NUCLEOTIDE PHOSPHORUS ESTER OLIGOMERS PHARMAGENICS, INC. (US) 1996-07-25 WO claimed
EP-0489877-B1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES UPJOHN CO (US) 1995-09-20 EP claimed
US-5302613-A Antiatheroscleroic and antithrombotic 2-amino-6-phenyl-4H-pyran-4-ones THE UPJOHN COMPANY (US) 1994-04-12 US claimed
US-5252735-A Antiatherosclerotic and antithrombotic 2-amino-6-phenyl-4H-pyran-4-ones THE UPJOHN COMPANY (US) 1993-10-12 US claimed
EP-0525123-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES. UPJOHN CO (US) 1993-02-03 EP claimed
WO-1992000290-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 2-AMINO-6-PHENYL-4H-PYRAN-4-ONES THE UPJOHN COMPANY (US) 1992-01-09 WO claimed
WO-1991019707-A2 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1991-12-26 WO claimed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP claimed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO claimed
EP-0331052-A2 Process for the preparation of imidized acrylic polymers ELF ATOCHEM ITALIA S.r.l. (IT) 1989-09-06 EP claimed