SCHEMBL9819007

SCHEMBL9819007

CCOC(=O)C=C1CCN(C(C)OC(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 2/20 0.43
ESR2 Q92731 1/20 0.41
TSHR P16473 1/20 0.41
GAA P10253 1/20 0.40
MDM4 O15151 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
MDM2 Q00987 1/20 0.39
ALDH1A1 P00352 3/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CACNA1A O00555 1/20 0.38
CACNA2D1 P54289 1/20 0.38
CACNB1 Q02641 1/20 0.38
OPRD1 P41143 1/20 0.38
SLC6A2 P23975 3/20 0.37
SLC6A3 Q01959 3/20 0.37
SLC6A4 P31645 2/20 0.37
KDM4E B2RXH2 2/20 0.37
CHRM2 P08172 1/20 0.37

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
SCHEMBL9870097 0.85 SRD5A2 (0.36) GAALMNAMAPTALDH1A1OPRD1
SCHEMBL9819011 0.78 SLC6A4 (0.54) SLC6A3SLC6A4
SCHEMBL9818773 0.76 ALDH1A1 (0.61) TSHRMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL1286824 0.75 RECQL (0.48) ESR2TSHRGAALMNAMAPT
SCHEMBL71975 0.75 CTDSP1 (0.49) CTDSP1TSHRGAAMDM4LMNA
SCHEMBL9819235 0.74 ALDH1A1 (0.42) TSHRGAALMNAALDH1A1SMN1; SMN2
SCHEMBL9818776 0.74 OPRD1 (0.52) LMNAALDH1A1SMN1; SMN2OPRD1KDM4E
SCHEMBL9818778 0.74 CYP2D6 (0.42) LMNAALDH1A1SLC6A2SLC6A3KDM4E
SCHEMBL4579407 0.73 KMT2A (0.56) ESR2LMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL10258319 0.73 BLM (0.51) ESR2TSHRGAALMNAALDH1A1

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-0259227-B1 BENZHYDRYLOXYETHYL PIPERIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Société anonyme: LES LABORATOIRES MERAM (FR) 1991-12-27 EP claimed
US-4983614-A ANTISPASMODIC, ANTIALLERGENIC AND ANTIHISTAMINE AGENTS LES LABORATOIRES MERAM (FR) 1991-01-08 US disclosed