SCHEMBL11374342

SCHEMBL11374342

O=C(Cl)c1cnoc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.39
RAB9A P51151 6/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
ALPL P05186 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ABCB1 P08183 1/20 0.37
SRD5A2 P31213 1/20 0.37

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
SCHEMBL4371450 0.88 SMN1; SMN2 (0.50) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL4368062 0.83 ALPL (0.49) ALDH1A1ALPLRXFP1KDM4EMAPT
SCHEMBL5773257 0.80 MAPT (0.51) NPC1RAB9AKMT2AALDH1A1SMN1; SMN2
SCHEMBL5775506 0.74 AHR (0.36) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5774926 0.73 TP53 (0.44) TP53SMN1; SMN2TSHRALPL
SCHEMBL11517887 0.71 POLB (0.47) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5773924 0.70 MAPT (0.44) TSHRALPLKDM4EMAPT
SCHEMBL5776428 0.70 SIRT2 (0.39) NPC1RAB9AALDH1A1SMN1; SMN2ALPL
SCHEMBL3054751 0.69 HCRTR1 (0.43) MEN1KMT2AALDH1A1TP53KDM4E
SCHEMBL5770512 0.69 MAPT (0.45) NPC1RAB9AKMT2AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4243406-A REDUCING INJURIES TO CROP PLANTS WHEN USING AN ALPHA-HALOACETANILIDE AS A HERBICIDE MONSANTO COMPANY (US) 1981-01-06 US disclosed