SCHEMBL23760200

SCHEMBL23760200

Cc1cccc2c3c(c(-c4ccccc4)n12)c1ccccc1n3-c1nc(-c2ccccc2)nc(-c2cccc3c2sc2ccccc23)n1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
PARP14 Q460N5 1/20 0.30

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
SCHEMBL23760203 0.86 L3MBTL1 (0.36)
SCHEMBL22036070 0.85 ALOX5 (0.34) ALOX5PARP14
SCHEMBL23760190 0.81 TP53 (0.33)
SCHEMBL23760205 0.81 TSHR (0.31)
SCHEMBL20988518 0.81 ALOX5 (0.38) ALOX5PARP14
SCHEMBL16811135 0.81 ALOX5 (0.41) ALOX5PARP14
SCHEMBL23760192 0.80 MAPT (0.33)
SCHEMBL24217972 0.80 ALOX5 (0.38) ALOX5PARP14
SCHEMBL16452184 0.80 ALOX5 (0.34) ALOX5PARP14
SCHEMBL16811140 0.80 ALOX5 (0.37) ALOX5PARP14

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-3630764-B1 HEXACYCLIC HETEROAROMATIC COMPOUNDS FOR USE IN ELEKTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-08-18 EP disclosed