SCHEMBL7367463

SCHEMBL7367463

N#Cc1ccc(N[C@H]2CC[C@@H](O)CC2)c(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.44
CDK2 P24941 1/20 0.42
MAP2K1 Q02750 1/20 0.41
PRKCQ Q04759 1/20 0.41
ALB P02768 1/20 0.40
PIM1 P11309 2/20 0.40
PIM2 Q9P1W9 1/20 0.40
HCAR3 P49019 1/20 0.40
SCN9A Q15858 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
SCHEMBL7367462 1.00 HSP90AA1 (0.44) HSP90AA1CDK2MAP2K1PRKCQALB
SCHEMBL15638342 0.89 HCAR3 (0.46) CDK2MAP2K1ALBHCAR3
SCHEMBL6946805 0.89 NPC1 (0.47) CDK2MAP2K1ALBHCAR3
SCHEMBL7367414 0.86 YAP1 (0.48) HSP90AA1SCN9A
SCHEMBL7185729 0.79 KDM4E (0.47) HSP90AA1PRKCQPIM1
SCHEMBL7185735 0.79 KDM4E (0.47) HSP90AA1PRKCQPIM1
SCHEMBL15635242 0.78 MAP2K1 (0.48) MAP2K1HCAR3
SCHEMBL8300943 0.77 ALB (0.47) CDK2MAP2K1ALB
SCHEMBL7185961 0.76 HCAR3 (0.56) HCAR3
SCHEMBL7185959 0.76 HCAR3 (0.56) HCAR3

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
WO-2001030745-A1 ANTHRANILIC ACID DERIVATIVES AS INHIBITORS OF THE CGMP-PHOSPHODIESTERASE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-03 WO disclosed