SCHEMBL8775796

SCHEMBL8775796

CCOC(=O)C=C(c1ccccc1)c1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 18/20 0.61
TBXA2R P21731 1/20 0.50
TP53 P04637 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
SCHEMBL8775833 1.00 TBXAS1 (0.61) TBXAS1TBXA2RTP53
SCHEMBL1070286 0.87 MEN1 (0.53)
SCHEMBL16474270 0.85 TBXAS1 (0.46) TBXAS1TBXA2RTP53
SCHEMBL6831006 0.85 TBXAS1 (0.47) TBXAS1TP53
SCHEMBL6830998 0.85 TBXAS1 (0.47) TBXAS1TP53
SCHEMBL6831002 0.85 TBXAS1 (0.47) TBXAS1TP53
SCHEMBL15765091 0.83 L3MBTL1 (0.50) TBXAS1TP53
SCHEMBL2422440 0.83 L3MBTL1 (0.50) TBXAS1TP53
SCHEMBL2422438 0.83 L3MBTL1 (0.50) TBXAS1TP53
SCHEMBL30930819 0.83 L3MBTL1 (0.50) TBXAS1TP53

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-0807626-A1 N-HYDROXYUREA DERIVATIVES Nikken Chemicals Company, Limited (JP) 1997-11-19 EP disclosed