SCHEMBL9725101

SCHEMBL9725101

CCCCNC(=O)c1ccc(O)c(O)c1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.55
NAAA Q02083 2/20 0.54
HDAC6 Q9UBN7 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
TRPV1 Q8NER1 1/20 0.52
CA2 P00918 1/20 0.52
APP P05067 1/20 0.50
MLYCD O95822 1/20 0.50
XDH P47989 1/20 0.50

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
SCHEMBL27907061 0.94 L3MBTL1 (0.65) SMN1; SMN2L3MBTL1NAAATRPV1CA2
SCHEMBL3626979 0.94 L3MBTL1 (0.65) SMN1; SMN2L3MBTL1NAAATRPV1CA2
SCHEMBL9725132 0.94 L3MBTL1 (0.65) SMN1; SMN2L3MBTL1NAAATRPV1CA2
SCHEMBL9142025 0.94 L3MBTL1 (0.65) SMN1; SMN2L3MBTL1NAAATRPV1CA2
SCHEMBL10029414 0.90 L3MBTL1 (0.58) SMN1; SMN2L3MBTL1HDAC6CA2XDH
SCHEMBL24440484 0.90 HDAC6 (0.60) SMN1; SMN2L3MBTL1HDAC6CA2XDH
SCHEMBL29633482 0.90 HDAC6 (0.60) SMN1; SMN2L3MBTL1HDAC6CA2XDH
SCHEMBL18619400 0.88 HDAC6 (0.58) SMN1; SMN2L3MBTL1NAAAHDAC6XDH
SCHEMBL28051808 0.86 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1NAAATSHRHTT
SCHEMBL15985355 0.85 HDAC6 (0.51) SMN1; SMN2HDAC6CA2XDH

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
US-5140020-A Antiinflammatory agents KUREHA KAGATU KOGYO KABUSHIKI KAISHA (JP) 1992-08-18 US claimed
EP-0142241-B1 DIHYDROXYBENZAMIDE DERIVATIVES HAVING ANTI-INFLAMMATORY ACTIVITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-12-02 EP claimed
EP-0142241-A1 Dihydroxybenzamide derivatives having anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-22 EP claimed
EP-0142241-A1 Dihydroxybenzamide derivatives having anti-inflammatory activity KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-05-22 EP disclosed