SCHEMBL8994723

SCHEMBL8994723

CN(C)c1ccc(C(=CC=O)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
MAPT P10636 4/20 0.54
HPGD P15428 3/20 0.54
CYP2A6 P11509 1/20 0.48
CYP2A13 Q16696 1/20 0.48
RAB9A P51151 4/20 0.47
NPC1 O15118 4/20 0.47
ALOX15 P16050 3/20 0.47
MAPK1 P28482 3/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 2/20 0.47
HBB P68871 1/20 0.47
HSD17B10 Q99714 1/20 0.46
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TP53 P04637 1/20 0.43
HDAC1 Q13547 1/20 0.43

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
SCHEMBL8140199 0.93 RAB9A (0.59) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL8140201 0.93 RAB9A (0.59) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL25321662 0.91 ALDH1A1 (0.56) ALDH1A1MAPTHPGDCYP2A6CYP2A13
SCHEMBL25317423 0.91 MAPT (0.53) ALDH1A1MAPTHPGDCYP2A6CYP2A13
SCHEMBL9017223 0.88 ALDH1A1 (0.49) ALDH1A1MAPTHPGDCYP2A6CYP2A13
SCHEMBL5070723 0.88 MAOB (0.55) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL5070722 0.88 MAOB (0.55) ALDH1A1MAPTHPGDRAB9ANPC1
SCHEMBL9815915 0.87 ALDH1A1 (0.56) ALDH1A1MAPTHPGDCYP2A6CYP2A13
SCHEMBL9846524 0.82 ALDH1A1 (0.48) ALDH1A1MAPTHPGDCYP2A6CYP2A13
SCHEMBL26128739 0.82 KMT2A (0.50) ALDH1A1MAPTHPGDCYP2A6CYP2A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955510-B Double-free radical photodiagnosis and treatment reagent and preparation method and application thereof 内蒙古大学 2025-01-28 CN claimed
CN-118955510-A Double-free radical photodiagnosis and treatment reagent and preparation method and application thereof 内蒙古大学 2024-11-15 CN claimed
CN-118955510-B Double-free radical photodiagnosis and treatment reagent and preparation method and application thereof 内蒙古大学 2025-01-28 CN disclosed
CN-118955510-A Double-free radical photodiagnosis and treatment reagent and preparation method and application thereof 内蒙古大学 2024-11-15 CN disclosed
EP-0651024-B1 Method of producing polymethine dyes MINNESOTA MINING & MFG (US) 1996-08-14 EP disclosed
EP-0651024-A1 Method of producing polymethine dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-03 EP disclosed
US-5386058-A Method of producing polymethine dyes MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-01-31 US disclosed
EP-0248590-B1 1,1,4,4-TETRAPHENYL-1,3- BUTADIENE DERIVATIVES AND ELECTROPHOTOGRAPHIC LIGHTSENSITIVE MATERIAL CONTAINING THEM Takasago Perfumery Co., Ltd. (JP) 1991-08-21 EP disclosed
EP-0353007-A2 Polymethine dyes suitable for optical recording media MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1990-01-31 EP disclosed
US-4751163-A CHARGE TRANSPORT LAYER; ELECTROSTATICS; DURABILITY, PERFORMANCE TAKASAGO PERFUMERY CO., LTD. (JP) 1988-06-14 US disclosed
EP-0248590-A1 1,1,4,4-Tetraphenyl-1,3- butadiene derivatives and electrophotographic lightsensitive material containing them Takasago Perfumery Co., Ltd. (JP) 1987-12-09 EP disclosed
US-3974147-A DIHYDRO-HETEROCYCLIC AMINES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1976-08-10 US disclosed