SCHEMBL5322375

SCHEMBL5322375

COC(=O)Nc1ccc(C)c(C2CCN(C(C)c3ccc(Sc4ccc(Cl)cc4)cc3)CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.41
ADRA1A P35348 1/20 0.41
OGA O60502 1/20 0.40
ACKR3 P25106 1/20 0.38
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
OPRM1 P35372 2/20 0.37
LRRK2 Q5S007 1/20 0.36
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
NPC1 O15118 1/20 0.35

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
SCHEMBL5319993 0.90 DRD2 (0.47) DRD2ADRA1AOGAMAPTLRRK2
SCHEMBL5324511 0.90 DRD2 (0.49) DRD2ADRA1AOGAMEN1KMT2A
SCHEMBL5394993 0.88 CHRM2 (0.47) DRD2ADRA1AOGAALDH1A1
SCHEMBL5388493 0.88 DRD2 (0.40) DRD2ADRA1AOGAACKR3OPRM1
SCHEMBL5320289 0.84 DRD2 (0.40) DRD2ADRA1AOGAMEN1KMT2A
SCHEMBL4617774 0.83 DRD2 (0.54) DRD2ADRA1AACKR3MEN1MAPT
SCHEMBL5320284 0.82 DRD2 (0.46) DRD2ADRA1AMEN1MAPTKMT2A
SCHEMBL5327258 0.82 DRD2 (0.46) DRD2ADRA1AOGAALDH1A1
SCHEMBL5323016 0.81 DRD2 (0.46) DRD2ADRA1AMEN1MAPTKMT2A
SCHEMBL5322376 0.81 DRD2 (0.46) DRD2ADRA1AMEN1MAPTKMT2A

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
WO-2007114916-A2 ARYLBENZYLPIPERIDINE COMPOUNDS H. LUNDBECK A/S (DK) 2007-10-11 WO claimed
WO-2007114916-A2 ARYLBENZYLPIPERIDINE COMPOUNDS H. LUNDBECK A/S (DK) 2007-10-11 WO disclosed