SCHEMBL483258

SCHEMBL483258

CC[C@]1(C(=O)O)CC[C@@H](c2ccc(OCc3ccccc3)cc2)N1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 8/20 0.45
YAP1 P46937 3/20 0.44
KCNH2 Q12809 1/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.40
GHSR Q92847 1/20 0.40

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
SCHEMBL4770854 1.00 PRMT5 (0.45) PRMT5YAP1KCNH2KDM4EMEN1
SCHEMBL484203 0.86 YAP1 (0.45) PRMT5YAP1KCNH2KDM4ETP53
SCHEMBL483518 0.86 YAP1 (0.45) PRMT5YAP1KCNH2KDM4ETP53
SCHEMBL483558 0.86 YAP1 (0.45) PRMT5YAP1KCNH2KDM4ETP53
Ethane SCHEMBL483694 0.86 YAP1 (0.45) PRMT5YAP1KCNH2KDM4ETP53
SCHEMBL483557 0.86 YAP1 (0.45) PRMT5YAP1KCNH2KDM4ETP53
SCHEMBL10167537 0.85 YAP1 (0.46) PRMT5YAP1KCNH2TP53GHSR
SCHEMBL10167532 0.84 YAP1 (0.44) PRMT5YAP1KCNH2TP53GHSR
SCHEMBL14019388 0.83 YAP1 (0.44) PRMT5YAP1KCNH2MAPTTP53
SCHEMBL1104560 0.83 YAP1 (0.44) PRMT5YAP1KCNH2TP53GHSR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153623-B2 Compounds Convergence Pharmaceuticals Limited (GB) 2012-04-10 US disclosed
EP-1934176-B1 QUATERNARY ALPHA-AMINOCARBOXAMIDE DERIVATIVES AS MODULATORS OF VOLTAGE-GATED SODIUM CHANNELS GLAXO GROUP LTD (GB) 2012-02-01 EP disclosed