SCHEMBL26977245

SCHEMBL26977245

Nc1n[nH]c2cc(CCCl)ccc12

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 15/20 0.51
JAK2 O60674 4/20 0.51
KDM4E B2RXH2 1/20 0.44
CYP3A4 P08684 1/20 0.44
GAA P10253 1/20 0.44
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
TGFBR1 P36897 6/20 0.41
AURKA O14965 5/20 0.41
AURKB Q96GD4 5/20 0.41
ROCK1 Q13464 2/20 0.41
CHUK O15111 1/20 0.41
RPS6KB1 P23443 1/20 0.41
CDK2 P24941 1/20 0.41
KDR P35968 1/20 0.41
SYK P43405 1/20 0.41
JAK3 P52333 1/20 0.41
MAP3K5 Q99683 1/20 0.41
SGK1 O00141 1/20 0.39

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
SCHEMBL6478361 0.81 JAK2 (0.58) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL30882695 0.80 PDPK1 (0.56) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL5391597 0.80 PDPK1 (0.56) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL11753776 0.80 PDPK1 (0.49) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL11963111 0.79 PDPK1 (0.47) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL4559295 0.79 SGK1 (0.49) PDPK1JAK2SGK1
SCHEMBL91579 0.79 PDPK1 (0.55) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL2144862 0.79 PDPK1 (0.59) PDPK1JAK2KDM4ECYP3A4GAA
Hydrochloric Acid SCHEMBL7425346 0.79 PDPK1 (0.55) PDPK1JAK2KDM4ECYP3A4GAA
SCHEMBL5430903 0.76 PRKAG1 (0.53) GAA

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-3871673-B1 NOVEL INDAZOLE COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2024-01-03 EP disclosed