SCHEMBL8517508

SCHEMBL8517508

C=CCc1cc(N)cc(CC=C)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.47
GABRB2 P47870 6/20 0.47
KDM4E B2RXH2 2/20 0.45
DHFR P00374 1/20 0.42
POLB P06746 1/20 0.40
AKR1B1 P15121 2/20 0.40
GAA P10253 2/20 0.39
XDH P47989 1/20 0.39
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ALDH2 P05091 1/20 0.38
HPGD P15428 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL9115480 0.86 ALOX5 (0.48) GABRA1GABRB2KDM4EDHFRGAA
SCHEMBL4149652 0.83 GABRA1 (0.59) GABRA1GABRB2KDM4EPOLBAKR1B1
SCHEMBL4045452 0.83 GABRA1 (0.48) GABRA1GABRB2KDM4EPOLBAKR1B1
SCHEMBL11766748 0.81 HSPA5 (0.43) GABRA1GABRB2KDM4EDHFRPOLB
SCHEMBL9960069 0.81 ALDH1A1 (0.47) GABRA1GABRB2KDM4EPOLBGAA
SCHEMBL2461750 0.81 XDH (0.48) GABRA1GABRB2KDM4EDHFRPOLB
SCHEMBL7852200 0.81 GABRA1 (0.47) GABRA1GABRB2KDM4EDHFRPOLB
SCHEMBL1420217 0.81 GABRA1 (0.47) GABRA1GABRB2KDM4EDHFRPOLB
SCHEMBL10487312 0.80 GABRA1 (0.47) GABRA1GABRB2KDM4EPOLBAKR1B1
SCHEMBL9284341 0.80 DHFR (0.43) GABRA1GABRB2KDM4EDHFRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0141419-B1 3,5-DIALKYL-4-HYDROXYPHENYL-SUBSTITUTED DERIVATIVES The B.F. GOODRICH Company (US) 1988-03-09 EP claimed
EP-0365127-B1 Substituted triazines UNIROYAL CHEM CO INC (US) 1999-01-27 EP disclosed
US-5120844-A Antiozonants for rubber UNIROYAL CHEMICAL COMPANY, INC. (US) 1992-06-09 US disclosed
US-4972010-A OXIDATION RESISTANCE FOR TIRES, RUBBERS UNIROYAL CHEMICAL COMPANY, INC. (US) 1990-11-20 US disclosed
EP-0365127-A1 Substituted triazines UNIROYAL CHEMICAL COMPANY, Inc. (US) 1990-04-25 EP disclosed
US-4038434-A ANTIOXIDANT STABILIZED EDIBLE COMPOSITIONS HOWARD HALL & COMPANY (US) 1977-07-26 US disclosed
US-4013621-A OXIDATION RESISTANCE CIBA-GEIGY CORPORATION (US) 1977-03-22 US disclosed