SCHEMBL28080025

SCHEMBL28080025

Nc1ccc2ccccc2c1N=C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP2 Q9HC62 2/20 0.44
SENP1 Q9P0U3 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SUMO2 P61956 1/20 0.44
SUMO1 P63165 1/20 0.44
SENP3 Q9H4L4 1/20 0.44
ALDH1A1 P00352 5/20 0.43
HSD17B10 Q99714 5/20 0.43
HPGD P15428 3/20 0.43
TSHR P16473 2/20 0.43
CYP3A4 P08684 2/20 0.43
KEAP1 Q14145 1/20 0.43
HPRT1 P00492 2/20 0.41
TDP1 Q9NUW8 4/20 0.41
CYP2A6 P11509 1/20 0.41
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
PAX8 Q06710 1/20 0.36
GLO1 Q04760 2/20 0.36
CYP1A2 P05177 2/20 0.36

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
SCHEMBL7159188 0.84 SENP2 (0.35) SENP2SENP1SENP7SUMO2SUMO1
SCHEMBL13596742 0.81 ALDH1A1 (0.43) SENP2SENP1SENP7SUMO2SUMO1
SCHEMBL38584 0.81 TDP1 (0.41) SENP7ALDH1A1HSD17B10HPGDTSHR
SCHEMBL29500990 0.81 TDP1 (0.41) SENP7ALDH1A1HSD17B10HPGDTSHR
SCHEMBL11028783 0.80 ALDH1A1 (0.46) SENP2SENP1SENP7SUMO2SUMO1
SCHEMBL1900115 0.79 CYP2A6 (0.48) SENP7ALDH1A1HSD17B10HPGDTSHR
SCHEMBL7195938 0.79 THRB (0.54) SENP7ALDH1A1HSD17B10HPGDTDP1
SCHEMBL1897887 0.79 ALDH1A1 (0.39) SENP7ALDH1A1HSD17B10HPGDTSHR
SCHEMBL5582407 0.79 ALDH1A1 (0.39) SENP7ALDH1A1HSD17B10HPGDTSHR
SCHEMBL31148851 0.79 TSHR (0.48) ALDH1A1HSD17B10HPGDTSHRCYP3A4

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
CN-105648779-A Anti-hairfalling antistatic finishing agent and preparation method thereof 吴江福汇缘家纺有限公司 2016-06-08 CN claimed
CN-105648779-A Anti-hairfalling antistatic finishing agent and preparation method thereof 吴江福汇缘家纺有限公司 2016-06-08 CN disclosed