SCHEMBL9628554

SCHEMBL9628554

CCc1sc(-c2ccccc2)nc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.62
L3MBTL1 Q9Y468 1/20 0.57
CDC7 O00311 1/20 0.54
DBF4 Q9UBU7 1/20 0.54
ALOX5 P09917 2/20 0.53
PTGDR2 Q9Y5Y4 1/20 0.51
MAPT P10636 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
SCHEMBL9629404 0.86 TRPM8 (0.59) TRPM8CDC7DBF4ALOX5
SCHEMBL14840398 0.84 CDC7 (0.55) TRPM8CDC7DBF4ALOX5MAPT
SCHEMBL9630543 0.83 TRPM8 (0.57) TRPM8L3MBTL1CDC7DBF4ALOX5
SCHEMBL1458929 0.82 ALOX5 (0.60) TRPM8CDC7DBF4ALOX5MAPT
SCHEMBL9630221 0.81 TRPM8 (0.54) TRPM8CDC7DBF4ALOX5PTGDR2
SCHEMBL11466220 0.80 ALDH1A1 (0.67) L3MBTL1PTGDR2MAPT
SCHEMBL6840453 0.80 L3MBTL1 (0.55) TRPM8L3MBTL1PTGDR2MAPT
SCHEMBL18015850 0.80 L3MBTL1 (0.55) TRPM8L3MBTL1PTGDR2MAPT
SCHEMBL6603517 0.79 L3MBTL1 (0.58) TRPM8L3MBTL1CDC7DBF4PTGDR2
SCHEMBL26141800 0.79 L3MBTL1 (0.54) TRPM8L3MBTL1ALOX5PTGDR2MAPT

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