SCHEMBL13002965

SCHEMBL13002965

CCC(Cc1cc(Cl)ccc1C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TP53 P04637 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ CNR1 P21554 3/20 0.42
▸ STS P08842 2/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ DPP4 P27487 1/20 0.41
▸ UTS2R Q9UKP6 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ MAPT P10636 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
SCHEMBL12713217 0.90 CNR1 (0.42) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713199 0.89 SMN1; SMN2 (0.45) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713213 0.89 SMN1; SMN2 (0.47) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL13948350 0.84 SMN1; SMN2 (0.45) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713201 0.82 SMN1; SMN2 (0.46) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713214 0.82 SMN1; SMN2 (0.46) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL13948343 0.82 TP53 (0.44) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL13940957 0.82 TP53 (0.44) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713212 0.81 TP53 (0.47) SMN1; SMN2TP53POLBCNR1STS
SCHEMBL12713141 0.81 SMN1; SMN2 (0.47) SMN1; SMN2TP53POLBCNR1STS

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
EP-2004604-B1 SUBSTITUTED PHENYLPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS CH (CH) 2010-12-01 — — EP disclosed
WO-2009015867-A1 SUBSTITUTED ARYL OR HETEROARYLPIPERDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2009-02-05 — — WO disclosed
Send feedback