SCHEMBL5695532

SCHEMBL5695532

CC(C1CCC1(O)c1ccc(Cl)cc1)N1CCN(C)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPT P10636 1/20 0.43
▸ OPRM1 P35372 5/20 0.42
▸ SLC6A3 Q01959 4/20 0.40
▸ SLC6A2 P23975 3/20 0.40
▸ CHRM2 P08172 2/20 0.40
▸ HTR1A P08908 2/20 0.40
▸ ADRA2A P08913 2/20 0.40
▸ CHRM1 P11229 2/20 0.40
▸ DRD1 P21728 2/20 0.40
▸ TBXA2R P21731 2/20 0.40
▸ SLC6A4 P31645 2/20 0.40
▸ ADRA1A P35348 2/20 0.40
▸ DRD3 P35462 2/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ BCL2 P10415 1/20 0.40
▸ HRH3 Q9Y5N1 1/20 0.40
▸ CYP2D6 P10635 2/20 0.39

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
SCHEMBL6041278 0.74 KMT2A (0.59) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL5695533 0.71 SLC6A2 (0.45) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL6043390 0.68 KMT2A (0.55) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL3591425 0.67 CCR3 (0.57) KMT2AOPRM1ADRA1AOPRL1OPRD1
SCHEMBL3444664 0.66 OPRM1 (0.53) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL16565843 0.65 OPRM1 (0.50) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL13563401 0.64 MC4R (0.67) ALDH1A1LMNAKMT2AOPRM1SLC6A3
SCHEMBL5962422 0.63 OPRM1 (0.63) ALDH1A1LMNAKMT2AOPRM1TSHR
SCHEMBL31210281 0.63 OPRM1 (0.59) ALDH1A1LMNAKMT2AMAPTOPRM1
SCHEMBL31210280 0.63 OPRM1 (0.59) ALDH1A1LMNAKMT2AMAPTOPRM1

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-1673358-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE Wyeth (US) 2006-06-28 — — EP disclosed
WO-2005037808-A1 PHENYLPIPERAZINE CYCLOALKANOL DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2005-04-28 — — WO disclosed
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