SCHEMBL7466233

SCHEMBL7466233

N#Cc1cc(Cl)ccc1S(N)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
VCAM1 P19320 1/20 0.42
SLC22A12 Q96S37 2/20 0.42
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
F10 P00742 1/20 0.40
TRPV4 Q9HBA0 4/20 0.40
PTGES2 Q9H7Z7 1/20 0.39

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
SCHEMBL19682467 0.83 TRPV4 (0.49) MEN1ALDH1A1KMT2AVCAM1SLC22A12
SCHEMBL8960506 0.83 VCAM1 (0.43) MEN1ALDH1A1KMT2AVCAM1SLC22A12
SCHEMBL1263198 0.81 CCR2 (0.45) MEN1ALDH1A1KMT2AVCAM1SLC22A12
SCHEMBL8960510 0.81 TRPV4 (0.43) MEN1ALDH1A1KMT2AVCAM1SLC22A12
SCHEMBL25176129 0.79 KDM4E (0.46) MEN1ALDH1A1KMT2ACA1CA2
SCHEMBL26598944 0.78 CA12 (0.46) MEN1KMT2ASLC22A12CA1CA2
SCHEMBL5194623 0.76 CA2 (0.52) ALDH1A1CA1CA2CA12CA9
SCHEMBL20451442 0.75 SLC22A12 (0.46) MEN1ALDH1A1KMT2AVCAM1SLC22A12
SCHEMBL962913 0.74 CA1 (0.53) CA1CA2CA12CA9CA3
SCHEMBL29587590 0.74 CA1 (0.53) CA1CA2CA12CA9CA3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795548-B1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LTD (JP) 2002-07-03 EP disclosed
US-5814631-A CHYMASE INHIBITOR, CARDIVASCULAR SUNTORY LIMITED (JP) 1998-09-29 US disclosed
EP-0795548-A1 QUINAZOLINE DERIVATIVES AND USE THEREOF SUNTORY LIMITED (JP) 1997-09-17 EP disclosed