SCHEMBL10696972

SCHEMBL10696972

CC1(C)C=C(n2nc(O)ccc2=O)c2cc(C(N)=S)ccc2O1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.31
RARB P10826 1/20 0.31
RARG P13631 1/20 0.31

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
SCHEMBL10697215 0.87 S100A4 (0.34) RARARARBRARG
SCHEMBL10697118 0.84 RAB9A (0.37) RARARARBRARG
SCHEMBL10693640 0.82 MAPT (0.41) RARARARB
SCHEMBL8088362 0.81 SLC9A1 (0.30)
SCHEMBL10696788 0.81
SCHEMBL10694147 0.80 ALDH1A1 (0.36)
SCHEMBL10694946 0.80 PDE4A (0.41)
SCHEMBL7276973 0.78 F10 (0.33) RARARARBRARG
SCHEMBL7377496 0.77 CCNC (0.30)
SCHEMBL7373684 0.74 CCNC (0.36)

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-0273262-A2 Chroman derivatives MERCK PATENT GmbH (DE) 1988-07-06 EP disclosed