SCHEMBL7143590

SCHEMBL7143590

CCCCNC(=O)N(S)c1ccc(F)c([Ti])c1F

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.38
RECQL P46063 1/20 0.38
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
HDAC3 O15379 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
HPGD P15428 3/20 0.33
ALOX5 P09917 1/20 0.32

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
SCHEMBL4355852 0.80 EPHX2 (0.48) EPHX2SMN1; SMN2RECQLHTTALDH1A1
SCHEMBL11514080 0.72 HPGD (0.44) SMN1; SMN2TSHRHTTNPC1ALDH1A1
SCHEMBL4350070 0.72 NAAA (0.40) EPHX2SMN1; SMN2HTTALDH1A1HPGD
SCHEMBL4348991 0.68 NAAA (0.52) TSHRHTTALOX5
SCHEMBL4349401 0.68 MGLL (0.38) EPHX2SMN1; SMN2HDAC3HDAC1HDAC2
SCHEMBL4354053 0.68 TRPV1 (0.44) EPHX2SMN1; SMN2
SCHEMBL7143587 0.67 SMN1; SMN2 (0.62) EPHX2SMN1; SMN2RECQLHTTNPC1
SCHEMBL4350102 0.67 TRPV1 (0.49) EPHX2
SCHEMBL4346809 0.67 TRPV1 (0.46) EPHX2ALDH1A1
SCHEMBL6847810 0.66 RIPK1 (0.37)

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
US-20030190554-A1 Photopolymerization; development using alkalinity developer FUJIFILM CORPORATION (JP) 2003-10-09 US disclosed