SCHEMBL9629581

SCHEMBL9629581

COc1ccc(-c2nc(O)c(C)s2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.68
KDM4E B2RXH2 1/20 0.63
MEN1 O00255 1/20 0.63
ALDH1A1 P00352 1/20 0.63
LMNA P02545 1/20 0.63
GAA P10253 1/20 0.63
MAPT P10636 1/20 0.63
KMT2A Q03164 1/20 0.63

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
SCHEMBL9436438 0.82 ALOX5 (0.66) ALOX5KDM4EALDH1A1MAPT
SCHEMBL9629237 0.82 ALOX5 (0.62) ALOX5KDM4EMEN1ALDH1A1LMNA
SCHEMBL9830647 0.79 ALDH1A1 (0.56) ALOX5KDM4EALDH1A1MAPT
SCHEMBL9629266 0.79 ALOX5 (0.63) ALOX5
SCHEMBL9629483 0.79 ALOX5 (0.58) ALOX5KDM4EMEN1ALDH1A1LMNA
SCHEMBL9629280 0.79 MAPT (0.58) ALOX5KDM4EMEN1ALDH1A1LMNA
SCHEMBL9628607 0.79 KDM4E (0.58) KDM4EMEN1ALDH1A1LMNAGAA
SCHEMBL9630548 0.78 ALOX5 (0.62) ALOX5
SCHEMBL9823302 0.78 PTGDR2 (0.53) ALOX5KDM4EALDH1A1GAAMAPT
SCHEMBL9629437 0.78 ALOX5 (1.00) ALOX5KDM4E

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