SCHEMBL9034110

SCHEMBL9034110

O=C1c2cccc3cccc(c23)C(=O)N1CCN1CCC(c2c[nH]c3cc(Cl)ccc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49
HTR7 P34969 2/20 0.47
HTR2A P28223 1/20 0.47
OPRM1 P35372 1/20 0.47
OPRK1 P41145 1/20 0.47
OPRL1 P41146 1/20 0.47
DRD2 P14416 2/20 0.45
SLC6A4 P31645 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
RAD52 P43351 1/20 0.44
CCR2 P41597 1/20 0.44
HTR1A P08908 1/20 0.44
HTR6 P50406 1/20 0.44

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
SCHEMBL9034427 0.93 OPRM1 (0.57) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9034357 0.89 DRD2 (0.60) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9033141 0.86 HTR2A (0.47) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9034241 0.86 HTR7 (0.45) KDM4EMAPTRAB9AHTR7HTR2A
SCHEMBL9034780 0.86 HTR1A (0.56) KDM4EALDH1A1LMNAHTR7HTR2A
SCHEMBL9034948 0.86 KCNH2 (0.52) KDM4EHTR7HTR2AOPRM1OPRL1
SCHEMBL9033694 0.85 HTR1D (0.52) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9034861 0.83 KDM4E (0.47) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9034575 0.83 MEN1 (0.48) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL9033683 0.83 SLC6A4 (0.64) HTR7HTR2AOPRM1OPRK1OPRL1

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-0722942-A1 Indole piperidine derivatives MERCK PATENT GmbH (DE) 1996-07-24 EP disclosed