SCHEMBL7483960

SCHEMBL7483960

COc1ccccc1Oc1c(O)nc(O)nc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CA1 P00915 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ CA12 O43570 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
▸ TP53 P04637 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ DHPS P49366 12/20 0.43
▸ NQO2 P16083 1/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP3A4 P08684 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
SCHEMBL5632966 0.87 HTT (0.47) HTTALDH1A1MAPK1L3MBTL1CA1
SCHEMBL5631066 0.86 HTT (0.46) HTTALDH1A1MAPK1L3MBTL1CA1
SCHEMBL7201140 0.83 ALPL (0.43) HTTALDH1A1MAPK1L3MBTL1CA1
SCHEMBL28568819 0.83 DHPS (0.59) ALDH1A1DHPSMAPT
SCHEMBL1937757 0.82 EDNRA (0.49) DHPS
SCHEMBL5632559 0.81 ALDH1A1 (0.48) HTTALDH1A1MAPK1L3MBTL1CA1
SCHEMBL31037841 0.79 DHPS (0.62) HTTALDH1A1MAPK1L3MBTL1TSHR
SCHEMBL31037845 0.79 HTR6 (0.46) HTTALDH1A1MAPK1L3MBTL1TSHR
SCHEMBL4061462 0.79 DHPS (0.49) ALDH1A1TP53DHPSSMN1; SMN2MAPT
SCHEMBL9423634 0.78 FFAR1 (0.51) HTTALDH1A1L3MBTL1TP53HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
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