SCHEMBL11158404

SCHEMBL11158404

CN(c1ccc(O)cc1)c1ccc(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FSCN1 Q16658 1/20 0.50
PTGS2 P35354 1/20 0.42
TSHR P16473 3/20 0.41
HSD17B10 Q99714 2/20 0.41
CHKA P35790 4/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 2/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 2/20 0.37
ALDH1A1 P00352 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
TP53 P04637 1/20 0.35
APP P05067 1/20 0.35
MEN1 O00255 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL22453194 0.82 FSCN1 (0.46) FSCN1TSHRCHKAKMT2AGAA
SCHEMBL11156542 0.79 MAPT (0.45) FSCN1CHKAKMT2AMAPTHPGD
SCHEMBL28984819 0.79 HSD17B10 (0.39) FSCN1PTGS2TSHRHSD17B10KMT2A
SCHEMBL11160853 0.78 PTGS2 (0.54) PTGS2HSD17B10CHKAPOLBALDH1A1
SCHEMBL28984816 0.76 PTGS2 (0.40) FSCN1PTGS2TSHRCHKAKMT2A
SCHEMBL11153653 0.73 TSHR (0.47) FSCN1TSHRGAACYP3A4ALDH1A1
SCHEMBL2616324 0.72 GAA (0.59) FSCN1PTGS2TSHRHSD17B10KMT2A
SCHEMBL11435307 0.71 MAPK1 (0.46) PTGS2TSHRKMT2AGAAPOLB
SCHEMBL926427 0.71 APP (0.52) PTGS2TSHRHSD17B10KMT2ACYP3A4
SCHEMBL10913732 0.69 PTGS2 (0.44) PTGS2CHKAKMT2APOLBALDH1A1

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
EP-0013144-B1 SUBSTITUTED DIPHENYLAMINE DERIVATIVES, COMPOSITIONS AND HERBICIDAL USES THEREOF, AND PROCESSES FOR THEIR PREPARATION ICI AUSTRALIA LIMITED (AU) 1983-02-23 EP disclosed
EP-0013144-A1 Substituted diphenylamine derivatives, compositions and herbicidal uses thereof, and processes for their preparation ICI AUSTRALIA LIMITED (AU) 1980-07-09 EP disclosed