SCHEMBL9770282

SCHEMBL9770282

O=[C]Nc1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
AHR P35869 2/20 0.31
CXCR1 P25024 1/20 0.31
CXCR2 P25025 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL448937 0.80 MEN1 (0.50) MAPK1MEN1KMT2A
SCHEMBL14855632 0.72 CYP2A6 (0.52) MEN1KMT2A
SCHEMBL2089857 0.71 HPGD (0.46) CYP3A4MAPK1TDP1
SCHEMBL1758628 0.71 MEN1 (0.50) MEN1KMT2A
SCHEMBL227130 0.70 CYP1A2 (0.44) MAPK1TDP1MEN1KMT2A
SCHEMBL5544097 0.70 CYP3A4 (0.33) CYP3A4MAPK1TDP1MEN1KMT2A
SCHEMBL2094786 0.69 HTR2A (0.41) CYP3A4MAPK1TDP1AHRCXCR1
SCHEMBL7554632 0.69 MAPT (0.41) CYP3A4MAPK1TDP1AHRCXCR1
SCHEMBL2094784 0.69 CYP3A4 (0.40) CYP3A4MAPK1TDP1AHRCXCR1
SCHEMBL1758465 0.68 PDK1 (0.44) MAPK1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4042591-A PIGMENTS, DISPERSE DYES SANDOZ LTD. (CH) 1977-08-16 US claimed
US-5051346-A Silver halide emulsion containing a coupler dispersed in oil droplets and another in an alkali aqueous solution; color films; improved photosensitivity, graininess, sharpness, reproduction KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1991-09-24 US disclosed
EP-0334362-A2 Heat developable color light-sensitive material Fuji Photo Film Co., Ltd. (JP) 1989-09-27 EP disclosed
US-4053465-A CYANOPHENYL-AZO-AMINOPHENYL DYESTUFFS BAYER AKTIENGESELLSCHAFT (DT) 1977-10-11 US disclosed
US-4042591-A PIGMENTS, DISPERSE DYES SANDOZ LTD. (CH) 1977-08-16 US disclosed