SCHEMBL7204802

SCHEMBL7204802

COc1ccccc1Oc1c(Cl)nc(Cl)nc1Cl

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHPS P49366 15/20 0.57
ALDH1A1 P00352 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA4 P22748 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PIN1 Q13526 1/20 0.46
MEN1 O00255 1/20 0.44

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
SCHEMBL5632471 0.89 DHPS (0.57) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL7304397 0.86 DHPS (0.62) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL7297418 0.83 DHPS (0.52) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL7330437 0.83 DHPS (0.59) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL5631299 0.83 DHPS (0.52) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL7303389 0.83 DHPS (0.81) DHPSALDH1A1HTTKMT2AMAPT
SCHEMBL29770374 0.82 DHPS (0.58) DHPS
SCHEMBL618135 0.82 DHPS (0.58) DHPS
SCHEMBL7197670 0.82 DHPS (0.51) DHPSALDH1A1L3MBTL1MAPK1HTT
SCHEMBL1748457 0.81 DHPS (0.50) DHPSALDH1A1L3MBTL1MAPK1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0852226-B1 PYRIMIDINE DERIVATIVES KOWA CO (JP) 2003-11-19 EP disclosed
EP-0959072-B1 Sulfonamide derivative and process for preparing the same TANABE SEIYAKU CO (JP) 2002-09-25 EP disclosed
EP-0959072-A1 Sulfonamide derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1999-11-24 EP disclosed
US-5883092-A Pyrimidine derivatives as endothelin antagonists KOWA CO., LTD. (JP) 1999-03-16 US disclosed
EP-0852226-A1 PYRIMIDINE DERIVATIVES KOWA CO. LTD. (JP) 1998-07-08 EP disclosed
US-5739333-A 4-SULFONAMIDO-6-ARYLOXY OR -AMINOALKYLENEOXY,-AMINO, OR -THIOPYRIMIDINES; ENDOLTHELIN ANTAGONISTS; HYPOTENSIVE AND ULCER AGENTS; ASTHMA; RAYNAUD DISEASE; CARDIOVASCULAR DISORDERS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0743307-A1 Sulfonamide derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1996-11-20 EP disclosed