SCHEMBL30103038

SCHEMBL30103038

COC(=O)c1cc(Cl)cc2cnn(Cc3ccc(-c4ccc(F)c(OC)c4)cn3)c12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 4/20 0.39
GRIN1 Q05586 8/20 0.38
GRIN2B Q13224 8/20 0.38
GRM5 P41594 1/20 0.37
GRM2 Q14416 1/20 0.36
TNIK Q9UKE5 2/20 0.35
FYN P06241 1/20 0.35
POLQ O75417 1/20 0.35
PLA2G2A P14555 1/20 0.35
ACLY P53396 1/20 0.35

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
SCHEMBL24784624 1.00 CACNA1H (0.39) CACNA1HGRIN1GRIN2BGRM5GRM2
SCHEMBL30103059 0.92 KDM4E (0.40) CACNA1HGRIN1GRIN2BGRM5GRM2
SCHEMBL30103113 0.90 CACNA1H (0.38) CACNA1HGRIN1GRIN2BTNIKPOLQ
SCHEMBL24785835 0.90 CACNA1H (0.38) CACNA1HGRIN1GRIN2BTNIKPOLQ
SCHEMBL30103044 0.86 AXL (0.40) GRM2PLA2G2AACLY
SCHEMBL24785362 0.86 AXL (0.40) GRM2PLA2G2AACLY
SCHEMBL24785079 0.86 CACNA1H (0.40) CACNA1HGRIN1GRIN2BPOLQ
SCHEMBL30018338 0.86 CACNA1H (0.40) CACNA1HGRIN1GRIN2BPOLQ
SCHEMBL30103022 0.84 CACNA1H (0.41) CACNA1HGRIN1GRIN2BGRM2TNIK
SCHEMBL24785813 0.83 GRIN2B (0.38) CACNA1HGRIN2BGRM2

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
CN-115448913-A Bicyclic compounds for the treatment of EP2, EP4 receptor mediated diseases 武汉人福创新药物研发中心有限公司 2022-12-09 CN disclosed