SCHEMBL20019695

SCHEMBL20019695

CN(C)CCCCC1COC2(CCN(C(=O)OC(C)(C)C)CC2)N1C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 12/20 0.38
▸ USP2 O75604 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ FAAH O00519 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ EPHX1 P07099 1/20 0.33

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
SCHEMBL12626420 0.79 GPR119 (0.43) GPR119
SCHEMBL12626413 0.77 GPR119 (0.38) GPR119USP2SMN1; SMN2RECQLFAAH
SCHEMBL21551547 0.68 GPR119 (0.52) GPR119USP2SMN1; SMN2RECQLFAAH
SCHEMBL22799095 0.66 USP2 (0.49) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL15740834 0.66 USP2 (0.42) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL1446828 0.66 HPGD (0.43) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL6152989 0.66 USP2 (0.47) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL17848671 0.66 USP2 (0.47) GPR119USP2SMN1; SMN2RECQLHPGD
SCHEMBL12626985 0.65 USP2 (0.40) GPR119USP2SMN1; SMN2RECQLFAAH
SCHEMBL2997902 0.65 LIMK2 (0.51) GPR119USP2SMN1; SMN2RECQLFAAH

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-2918587-B1 Filamin A binding compounds and their use as anti-inflammatory and analgesic agents PAIN THERAPEUTICS INC (US) 2018-04-04 — — EP disclosed
Send feedback