SCHEMBL3875652

SCHEMBL3875652

CC(c1ccc(CCCC(=O)c2ccc(-c3ccc(Cl)cc3)cc2)cc1)N1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 7/20 0.47
HTR2A P28223 4/20 0.44
CHRM1 P11229 3/20 0.44
CYP2D6 P10635 1/20 0.44
HRH3 Q9Y5N1 3/20 0.44
CHRNA7 P36544 1/20 0.41
TP53 P04637 1/20 0.40
DPP4 P27487 1/20 0.40
PTGER1 P34995 1/20 0.40
DRD2 P14416 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2C P28335 1/20 0.39
HTR7 P34969 1/20 0.39
HRH1 P35367 1/20 0.39
DRD3 P35462 1/20 0.39
HTR2B P41595 1/20 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
SCHEMBL3879247 0.90 RAB9A (0.48) HRH3DPP4
SCHEMBL13646639 0.85 TDP1 (0.56) CYP2D6DPP4
Hydrochloric Acid SCHEMBL3881259 0.84 TDP1 (0.55) CYP2D6DPP4
SCHEMBL3879241 0.81 MCHR1 (0.69) MCHR1HTR2ACHRM1CYP2D6TP53
SCHEMBL3868700 0.81 MCHR1 (0.65) MCHR1HTR2ACHRM1CYP2D6HRH3
SCHEMBL3875273 0.81 MCHR1 (0.69) MCHR1HTR2ACHRM1CYP2D6TP53
SCHEMBL3869879 0.81 MCHR1 (0.69) MCHR1HTR2ACHRM1CYP2D6TP53
SCHEMBL3872747 0.79 CHRM1 (0.49) MCHR1HTR2ACHRM1HRH3
SCHEMBL13646635 0.76 CCR1 (0.47) MCHR1
Hydrochloric Acid SCHEMBL3870567 0.75 CCR1 (0.46) MCHR1

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 4/4885HTR2A 94/4885CHRM1 217/4885

“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.