SCHEMBL21101566

SCHEMBL21101566

Cc1ccc2c(c1)C1C=C(c3ccc4c(c3)c3cc(C)ccc3n4-c3ccccc3)C=CC1O2

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
EDNRA P25101 3/20 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
SCHEMBL17570850 0.94 TP53 (0.32) TP53EDNRA
SCHEMBL19596215 0.85 KDM4E (0.38) EDNRA
SCHEMBL21102046 0.84 BCHE (0.37)
SCHEMBL21101414 0.79 MAPT (0.32) TP53
SCHEMBL21101415 0.79 BCHE (0.32)
SCHEMBL21101718 0.78
SCHEMBL21101504 0.77 MAPT (0.34) TP53
SCHEMBL25568739 0.77 PTGER4 (0.33) EDNRA
SCHEMBL20881578 0.76 PDE10A (0.31)
SCHEMBL12968551 0.76

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-2993215-B1 Azabenzimidazo[2,1-a]benzimidazoles for electronic applications IDEMITSU KOSAN CO (JP) 2019-06-19 EP disclosed