SCHEMBL9507879

SCHEMBL9507879

Clc1ccc2[c]cc[c]c2c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.46
TSHR P16473 8/20 0.40
CYP3A4 P08684 5/20 0.40
HSD17B10 Q99714 2/20 0.40
TDP1 Q9NUW8 4/20 0.37
MAPK1 P28482 3/20 0.37
CYP2A6 P11509 2/20 0.37
LMNA P02545 1/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX15 P16050 1/20 0.36
IDO1 P14902 1/20 0.36
AHR P35869 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CASP1 P29466 1/20 0.34
S100A4 P26447 1/20 0.33

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
SCHEMBL644419 0.75 CYP2A6 (0.50) TP53TSHRCYP3A4HSD17B10TDP1
SCHEMBL643621 0.74 CYP2A6 (0.48) TP53TSHRCYP3A4TDP1CYP2A6
SCHEMBL1299258 0.74 TP53 (0.37) TP53TSHRCYP3A4HSD17B10TDP1
SCHEMBL28957262 0.72 POLB (0.40) TP53TSHRCYP3A4CYP2A6LMNA
SCHEMBL3922969 0.71
SCHEMBL1921786 0.71 TP53 (0.30) TP53
SCHEMBL4455873 0.71 NR4A2 (0.43) HSD17B10TDP1LMNASMN1; SMN2ALOX15
SCHEMBL11030089 0.71 TP53 (0.43) TP53TSHRCYP3A4HSD17B10TDP1
SCHEMBL6048390 0.70 HSD17B10 (0.35) TSHRCYP3A4HSD17B10TDP1LMNA
SCHEMBL2250860 0.70 CYP1A2 (0.39) TP53CYP3A4HSD17B10TDP1CYP2A6

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-0241423-B1 PROCESS FOR THE PRODUCTION OF POSITIVE IMAGES CIBA-GEIGY AG (CH) 1993-09-15 EP disclosed
EP-0241423-A2 Process for the production of positive images CIBA-GEIGY AG (CH) 1987-10-14 EP disclosed