SCHEMBL8991513

SCHEMBL8991513

CCCCc1ccccc1/N=C\c1ccccc1N(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ LIPG Q9Y5X9 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.33
▸ MAPT P10636 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ L3MBTL1 Q9Y468 3/20 0.32
▸ POLB P06746 1/20 0.32

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
SCHEMBL9358818 0.96 CYP3A4 (0.48) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL11862057 0.81 CYP3A4 (0.56) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL8669451 0.78 CA2 (0.46) CYP3A4CYP2D6CYP2C9CA12CA2
SCHEMBL11873979 0.78 CYP3A4 (0.52) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL3000531 0.78 CYP3A4 (0.52) CYP3A4CYP2D6CYP2C9ALDH1A1KDM4E
SCHEMBL9656596 0.78 CYP3A4 (0.52) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL9292208 0.77 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9ALDH1A1MAPT
SCHEMBL11810613 0.77 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL7644622 0.76 CYP3A4 (0.60) CYP3A4CYP2D6CYP2C9LIPGCA12
SCHEMBL5529272 0.76 CYP2C9 (0.47) CYP3A4CYP2D6CYP2C9LIPGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0510410-B1 Diene polymers and copolymers jumped by partial coupling and terminated with a substituted imine BRIDGESTONE FIRESTONE INC (US) 1996-06-12 — — EP claimed
EP-0451604-B1 Diene polymers and copolymers terminated by reaction with n-alkyl and n-aryl imines BRIDGESTONE FIRESTONE INC (US) 1994-12-21 — — EP claimed
US-5247009-A Reacted with an imine and an acid halide, tires NIPPON ZEON CO., LTD. (JP) 1993-09-21 — — US claimed
US-4677153-A REACTING WITH AN ACYL HALIDE AND NIPPON ZEON CO., LTD. (JP) 1987-06-30 — — US claimed
EP-0438248-B1 Preparation process of toner NIPPON ZEON CO (JP) 1996-07-24 — — EP disclosed
US-5312849-A Modified diene polymer, carbon black NIPPON ZEON CO., LTD. (JP) 1994-05-17 — — US disclosed
US-5247009-A Reacted with an imine and an acid halide, tires NIPPON ZEON CO., LTD. (JP) 1993-09-21 — — US disclosed
US-5217839-A Dispersion containing mixture of a polymer with a carbon nitrogen double bond and a colorant in a vinyl monomer NIPPON ZEON CO., LTD. (JP) 1993-06-08 — — US disclosed
US-5110886-A Cationic polymer having at least one heterocyclic ring NIPPON ZEON CO., LTD. (JP) 1992-05-05 — — US disclosed
EP-0441286-A1 Compatibilizing agent and polymer blend composition using the same NIPPON ZEON CO., LTD. (JP) 1991-08-14 — — EP disclosed
EP-0438248-A2 Preparation process of toner NIPPON ZEON CO., LTD. (JP) 1991-07-24 — — EP disclosed
EP-0198294-B1 METHOD FOR MODIFYING RUBBERS NIPPON ZEON CO., LTD. (JP) 1989-01-04 — — EP disclosed
US-4677153-A REACTING WITH AN ACYL HALIDE AND NIPPON ZEON CO., LTD. (JP) 1987-06-30 — — US disclosed
EP-0198294-A1 Method for modifying rubbers NIPPON ZEON CO., LTD. (JP) 1986-10-22 — — EP disclosed
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