SCHEMBL10972244

SCHEMBL10972244

OC(c1cccnc1)c1ccc(Cl)cc1Cl.c1ccc(-c2cccc(COCc3cccc(-c4ccccc4)c3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
IDO1 P14902 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SUCNR1 Q9BXA5 2/20 0.41
KCNA5 P22460 2/20 0.41
FFAR1 O14842 1/20 0.41
GAA P10253 1/20 0.39
CYP17A1 P05093 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
GRM5 P41594 2/20 0.39
TACR1 P25103 2/20 0.38
TBXA2R P21731 1/20 0.38
PTGER1 P34995 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
SCHEMBL10966366 0.92 CYP17A1 (0.43) IDO1SMN1; SMN2SUCNR1KCNA5GAA
SCHEMBL11136578 0.90 MRGPRX4 (0.40) PDCD1CD274IDO1FFAR1MRGPRX4
SCHEMBL10972240 0.84 IDO1 (0.48) PDCD1CD274IDO1SUCNR1KCNA5
SCHEMBL11026298 0.84 CYP19A1 (0.43) IDO1KCNA5FFAR1GAAMRGPRX4
SCHEMBL10968614 0.82 CYP2C9 (0.42) IDO1SMN1; SMN2KCNA5GAACYP17A1
SCHEMBL10968531 0.81 SMN1; SMN2 (0.46) PDCD1CD274SMN1; SMN2SUCNR1KCNA5
SCHEMBL11132188 0.81 IDO1 (0.39) IDO1CYP17A1MRGPRX4TACR1TBXA2R
SCHEMBL10967991 0.81 SMN1; SMN2 (0.53) IDO1SMN1; SMN2KCNA5GAACYP17A1
SCHEMBL10965347 0.80 IDO1 (0.48) IDO1SMN1; SMN2GAACYP17A1GRM5
SCHEMBL10971823 0.78 CYP17A1 (0.53) SMN1; SMN2SUCNR1KCNA5CYP17A1MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0148826-A1 FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS CHEVRON RESEARCH AND TECHNOLOGY COMPANY (US) 1985-07-24 EP disclosed
WO-1985000289-A1 FUNGICIDAL, HERBICIDAL AND PLANT GROWTH REGULATING PYRIDYL-CONTAINING ETHERS CHEVRON RESEARCH COMPANY (US) 1985-01-31 WO disclosed
US-4407806-A PRE- AND POSTEMERGENCE HERBICIDES CHEVRON RESEARCH COMPANY (US) 1983-10-04 US disclosed