SCHEMBL7946243

SCHEMBL7946243

CSc1cccc(Cl)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
CYP2A6 P11509 1/20 0.40
FABP4 P15090 6/20 0.39
FABP3 P05413 5/20 0.39
FABP5 Q01469 1/20 0.39
KDM4E B2RXH2 5/20 0.39
RAB9A P51151 3/20 0.39
HPGD P15428 3/20 0.39
LMNA P02545 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
NPSR1 Q6W5P4 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL7194276 0.83 CYP2A6 (0.43) MAPTKMT2AMEN1CYP2A6FABP4
SCHEMBL308199 0.78 CYP2A6 (0.55) MAPTALDH1A1CYP2A6FABP4FABP3
SCHEMBL27460879 0.78 ALDH1A1 (0.47) MAPTKMT2AALDH1A1SMN1; SMN2CYP2A6
SCHEMBL28151401 0.76 ALDH1A1 (0.40) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL3788453 0.76 MAPT (0.41) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL23765127 0.76 ALDH1A1 (0.33) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL255293 0.75
SCHEMBL31336772 0.75
SCHEMBL31568871 0.74 TSHR (0.42) MAPTKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL24031045 0.73 ALDH1A1 (0.38) MAPTKMT2AMEN1ALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US disclosed
US-6010981-A 1-alkyl-4-benzoyl-5-hydroxypyrazole compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-01-04 US disclosed