SCHEMBL9629249

SCHEMBL9629249

Cc1sc(-c2cccs2)nc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 2/20 0.51
GAA P10253 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL10091957 0.81 KDM4E (0.61) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL6496780 0.77 KDM4E (0.64) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL20836643 0.77 KDM4E (0.60) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL6760831 0.76 KDM4E (0.49) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL352099 0.76 KDM4E (0.55) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL10717905 0.75 RARA (0.52) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL17374796 0.73 KDM4E (0.56) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL2375004 0.72 KDM4E (0.58) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL17374827 0.72 TRPM8 (0.58) KDM4EALDH1A1GAANPC1RAB9A
SCHEMBL9630548 0.72 ALOX5 (0.62)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5124342-A Antiinflammatory, antiarthritic agents; antiallergens; skin disorders ABBOTT LABORATORIES (US) 1992-06-23 US disclosed
EP-0457803-A4 4-HYDROXYTHIAZOLES AS 5-LIPOXYGENASE INHIBITORS 1991-12-04 EP disclosed
EP-0457803-A1 4-HYDROXYTHIAZOLES AS 5-LIPOXYGENASE INHIBITORS ABBOTT LABORATORIES (US) 1991-11-27 EP disclosed
WO-1990009801-A1 4-HYDROXYTHIAZOLES AS 5-LIPOXYGENASE INHIBITORS ABBOTT LABORATORIES (US) 1990-09-07 WO disclosed
WO-1990009381-A1 4-HYDROXYTHIAZOLES AS 5-LIPOXYGENASE INHIBITORS ABBOTT LABORATORIES (US) 1990-08-23 WO disclosed