SCHEMBL11037709

SCHEMBL11037709

COc1cc(N2C(=O)C3CS(=O)(=O)CCN3C2=O)c(F)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPOX P50336 9/20 0.53
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 2/20 0.36
HSP90AA1 P07900 1/20 0.36
PKM P14618 1/20 0.36
MAPK1 P28482 1/20 0.36
CCR6 P51684 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL11480931 0.91 PPOX (0.40) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL11042402 0.89 PPOX (0.45) PPOXPKMGAA
SCHEMBL10613566 0.81 PPOX (0.65) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL11464675 0.80 PPOX (0.40) PPOXALDH1A1MAPTNPSR1LMNA
SCHEMBL10938893 0.80 PPOX (0.54) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL11071228 0.79 AR (0.37) ALDH1A1HTR2CGAAKMT2A
SCHEMBL10694288 0.75 PPOX (0.57) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL10691744 0.73 PPOX (0.50) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL11462224 0.72 PPOX (0.39) PPOXALDH1A1MAPTRAB9AHSP90AA1
SCHEMBL10694074 0.72 PPOX (0.61) PPOXALDH1A1MAPTRAB9AHSP90AA1

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-4437877-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-03-20 US claimed
EP-0070389-A2 2-(2-Fluoro-4-halo-5-substituted phenyl) hydantoins, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-01-26 EP claimed