SCHEMBL3867723

SCHEMBL3867723

O=C(NCCc1ccc(CN2CCCC2)cc1)c1ccc(OCC2CC2)cc1F

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.62
CHRM1 P11229 2/20 0.49
CHRM2 P08172 1/20 0.49
CHRM5 P08912 1/20 0.49
CHRM3 P20309 1/20 0.49
PARP10 Q53GL7 2/20 0.49
PARP15 Q460N3 1/20 0.49
HRH3 Q9Y5N1 1/20 0.48
SCN9A Q15858 2/20 0.47
CHRM4 P08173 2/20 0.47
CYP2D6 P10635 1/20 0.46
HTR2A P28223 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.43
SCN7A Q01118 1/20 0.43
SCN5A Q14524 1/20 0.43

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
SCHEMBL3867767 0.91 MCHR1 (0.60) MCHR1CHRM1CHRM2CHRM5CHRM3
SCHEMBL3881263 0.84 MCHR1 (0.62) MCHR1CHRM1HRH3CHRM4CYP2D6
SCHEMBL3867725 0.84 PARP10 (0.46) MCHR1PARP10PARP15HRH3SCN9A
SCHEMBL3868654 0.83 MCHR1 (0.60) MCHR1CHRM1CHRM2CHRM5CHRM3
SCHEMBL3879870 0.83 MCHR1 (0.63) MCHR1CHRM1HRH3CHRM4CYP2D6
SCHEMBL3869715 0.83 MCHR1 (0.63) MCHR1CHRM1HRH3CHRM4CYP2D6
SCHEMBL3874070 0.80 MCHR1 (0.78) MCHR1CHRM1CHRM2CHRM5CHRM3
SCHEMBL3870965 0.78 MCHR1 (0.75) MCHR1CHRM1CHRM2CHRM5CHRM3
SCHEMBL3872737 0.78 MCHR1 (0.86) MCHR1CHRM1CHRM2CHRM5CHRM3
SCHEMBL3868677 0.77 MCHR1 (1.00) MCHR1CHRM1CHRM2CHRM5CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601868-B2 Such as 4-(cyclopropylmethoxy)-N-(2-{4-[1-(1-pyrrolidinyl)ethyl]phenyl}ethyl)benzamide having melanin-concentrating hormone antagonistic action, for prophylaxis and/or treatment of obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-13 US disclosed
US-7601868-B2 Such as 4-(cyclopropylmethoxy)-N-(2-{4-[1-(1-pyrrolidinyl)ethyl]phenyl}ethyl)benzamide having melanin-concentrating hormone antagonistic action, for prophylaxis and/or treatment of obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-13 US disclosed
US-7601868-B2 Such as 4-(cyclopropylmethoxy)-N-(2-{4-[1-(1-pyrrolidinyl)ethyl]phenyl}ethyl)benzamide having melanin-concentrating hormone antagonistic action, for prophylaxis and/or treatment of obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-13 US disclosed
US-20060128690-A1 Amine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-15 US disclosed
EP-1593667-A1 AMINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2005-11-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060128690-A1 Amine derivative MC1R, MC2R, MC4R MCHR1 4/4885CHRM1 217/4885CHRM2 325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.