SCHEMBL6225698

SCHEMBL6225698

CC(C)C(Cl)CCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
CYP2A6 P11509 1/20 0.44
HTR2A P28223 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
POLB P06746 1/20 0.44
SIGMAR1 Q99720 2/20 0.44
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.43
HPGD P15428 1/20 0.43
OPRK1 P41145 1/20 0.42

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
SCHEMBL9819003 0.86 HTR2A (0.52) KDM4EMEN1KMT2ASMN1; SMN2CYP2A6
SCHEMBL2239690 0.82 MEN1 (0.49) KDM4EMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL6569937 0.77 TSHR (0.48) KDM4EMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL167715 0.77 AOC3 (0.55) MEN1KMT2ATSHRSMN1; SMN2POLB
SCHEMBL4785593 0.77 TSHR (0.52) KDM4EMEN1KMT2ATSHRSMN1; SMN2
Benzene SCHEMBL27914804 0.77 AOC3 (0.55) MEN1KMT2ATSHRSMN1; SMN2POLB
SCHEMBL10697566 0.77 TSHR (0.52) KDM4EMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL4237177 0.77 ALDH1A1 (0.48) KDM4EMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL29187623 0.77 ALDH1A1 (0.48) KDM4EMEN1KMT2ATSHRSMN1; SMN2
SCHEMBL19066702 0.76 TAAR1 (0.56) MEN1KMT2ASMN1; SMN2CYP2A6HTR2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411942-A4 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMA CORP (US) 2005-01-26 EP disclosed
EP-1411942-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS Synaptic Pharmaceutical Corporation (US) 2004-04-28 EP disclosed
WO-2003004027-A1 SUBSTITUTED ANILINIC PIPERIDINES AS MCH SELECTIVE ANTAGONISTS SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2003-01-16 WO disclosed