Aniline

Aniline

SCHEMBL9418488

C=C(C)C(=O)Nc1ccccc1.Nc1ccccc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
RXFP1 Q9HBX9 1/20 0.53
NAPRT Q6XQN6 1/20 0.52
HSD17B10 Q99714 1/20 0.52
RAB9A P51151 4/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 3/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 2/20 0.46
TAAR1 Q96RJ0 2/20 0.46
MEN1 O00255 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
EPHX1 P07099 2/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
EPHX2 P34913 1/20 0.45
CDK9 P50750 1/20 0.45
CLK4 Q9HAZ1 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
SCHEMBL219147 0.91 KDM4E (0.66) ALDH1A1KDM4ETDP1RXFP1NAPRT
SCHEMBL9011492 0.87 KDM4E (0.58) ALDH1A1KDM4ETDP1RXFP1NAPRT
SCHEMBL3298240 0.87 RXFP1 (0.62) ALDH1A1KDM4ETDP1RXFP1RAB9A
Dimethylamine SCHEMBL10625504 0.87 KDM4E (0.61) ALDH1A1KDM4ETDP1RXFP1NAPRT
Trimethylammonium SCHEMBL11436463 0.85 KDM4E (0.59) ALDH1A1KDM4ETDP1RXFP1NAPRT
Hydrochloric Acid SCHEMBL6673965 0.85 RXFP1 (0.61) ALDH1A1KDM4ETDP1RXFP1RAB9A
SCHEMBL10024755 0.84 ALDH1A1 (0.69) ALDH1A1KDM4ETDP1RXFP1HSD17B10
SCHEMBL166821 0.84 MAPT (0.67) ALDH1A1KDM4ETDP1RXFP1NAPRT
SCHEMBL19501001 0.84 NPC1 (0.67) ALDH1A1KDM4ETDP1RXFP1NAPRT
SCHEMBL10344971 0.81 KDM4E (0.51) ALDH1A1KDM4ETDP1RXFP1NAPRT

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
CN-104910298-B The nitrile rubber and its manufacturing method of hydrogenation containing aminomethyl 阿朗新科德国有限责任公司 2019-03-08 CN disclosed
CN-104910298-A Hydrogenated nitrile rubber containing amino methyl group and method for producing the same LANXESS DEUTSCHLAND GMBH 2015-09-16 CN disclosed
EP-0385918-B1 Crosslinkable rubber composition GOODYEAR TIRE & RUBBER (US) 1994-01-26 EP disclosed
US-5173557-A Having pendant blocked isocyanate groups and at least one zerewitinoff active hydrogen; thermal curing THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-12-22 US disclosed
US-5043455-A Sulfur-free THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-08-27 US disclosed
US-4983684-A Heating rubber having pendant, blocked isocyanate groups and compound having Zerewitinoff active hydrogens THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-01-08 US disclosed
EP-0385918-A1 Crosslinkable rubber composition THE GOODYEAR TIRE & RUBBER COMPANY (US) 1990-09-05 EP disclosed