SCHEMBL21763673

SCHEMBL21763673

Cc1ccc(-c2ccc3c(C=O)c(O)ccc3c2)s1

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 20/20 0.70

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
SCHEMBL21763550 0.86 ERN1 (0.70) ERN1
SCHEMBL12767176 0.83 ERN1 (1.00) ERN1
SCHEMBL12675796 0.81 ERN1 (0.74) ERN1
SCHEMBL12675803 0.81 ERN1 (0.74) ERN1
SCHEMBL12767154 0.81 ERN1 (1.00) ERN1
SCHEMBL18717305 0.80 ERN1 (0.70) ERN1
SCHEMBL21763340 0.78 ERN1 (0.61) ERN1
SCHEMBL29946531 0.78 ERN1 (0.61) ERN1
SCHEMBL21763675 0.77 ERN1 (0.60) ERN1
SCHEMBL12277731 0.77 PGR (0.57) ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496230-B1 IRE-1 ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH INC (CN) 2020-02-26 EP disclosed