SCHEMBL17505170

SCHEMBL17505170

CCCc1c(F)c(=O)[nH]c2ccc(N)cc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.49
▸ TSHR P16473 1/20 0.49
▸ PARP1 P09874 2/20 0.48
▸ RAB9A P51151 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ AR P10275 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.40
▸ CA12 O43570 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ NGFR P08138 1/20 0.38
▸ PPARG P37231 2/20 0.38
▸ GHSR Q92847 1/20 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
SCHEMBL17505177 0.83 PARP1 (0.46) HSD17B10TSHRPARP1ALDH1A1HPGD
SCHEMBL17505187 0.81 HSD17B10 (0.74) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505141 0.81 TSHR (0.47) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505189 0.80 HSD17B10 (0.52) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505210 0.80 ALDH1A1 (0.65) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505193 0.79 PARP1 (0.52) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505150 0.78 HSD17B10 (0.50) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL1771247 0.72 AR (0.55) PARP1KDM4EMAPTARCA12
SCHEMBL17505203 0.72 HSD17B10 (0.56) HSD17B10TSHRPARP1RAB9AALDH1A1
SCHEMBL17505183 0.72 KDM4E (0.50) HSD17B10TSHRPARP1ALDH1A1HPGD

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
WO-2016022915-A1 6-SULFONYLAMINO QUINOLINE COMPOUNDS AS PLANT GROWTH REGULATORS THE REGENT OF THE UNIVERSITY OF CALIFORNIA (US) 2016-02-11 — — WO disclosed
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