SCHEMBL8634239

SCHEMBL8634239

CNC(=O)N1CCC(Cc2cccc(OC)c2)CC1

nearest known ligand 0.68

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 6/20 0.64
HTR1A P08908 1/20 0.63
SLC6A4 P31645 1/20 0.63
MEN1 O00255 1/20 0.60
KMT2A Q03164 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
EED O75530 1/20 0.53
CHRM4 P08173 1/20 0.52

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
SCHEMBL8634509 0.88 CCR3 (0.59) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL8636409 0.84 KDM4E (0.61) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL4239734 0.82 CCR3 (0.54) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL8636890 0.82 HTR1A (0.56) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL7362108 0.82 FAAH (0.72) MEN1KMT2ASMN1; SMN2
SCHEMBL16825188 0.81 TGFBR1 (0.56) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL27233570 0.81 EPHX2 (0.71) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL12466446 0.80 MEN1 (0.56) CCR3HTR1ASLC6A4MEN1KMT2A
SCHEMBL27004162 0.80 FAAH (0.60) CCR3
SCHEMBL14421472 0.79 HTR1A (0.71) HTR1ASLC6A4EED

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718286-B1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL MYERS SQUIBB CO (US) 1998-07-29 EP claimed
EP-0718286-A1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL-MYERS SQUIBB COMPANY (US) 1996-06-26 EP claimed
US-5530012-A FOR SLEEP DISORDERS, DEPRESSION, GLAUCOMA, CANCER BRISTOL-MYERS SQUIBB CO. (US) 1996-06-25 US claimed
EP-0718286-B1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL MYERS SQUIBB CO (US) 1998-07-29 EP disclosed
EP-0718286-A1 3-Alkoxybenzylpiperidine derivatives as melatonergic agents BRISTOL-MYERS SQUIBB COMPANY (US) 1996-06-26 EP disclosed
US-5530012-A FOR SLEEP DISORDERS, DEPRESSION, GLAUCOMA, CANCER BRISTOL-MYERS SQUIBB CO. (US) 1996-06-25 US disclosed