SCHEMBL3869034

SCHEMBL3869034

O=C(C/C=C/c1ccc(CN2CCCC2)cc1)N1CCC(c2ccc(Cl)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CCR2 P41597 4/20 0.48
LSS P48449 1/20 0.48
MCHR1 Q99705 3/20 0.47
HTR2C P28335 1/20 0.47
CHRM1 P11229 2/20 0.47
HTR2A P28223 2/20 0.47
CHRM4 P08173 1/20 0.46
GRM5 P41594 1/20 0.45
GPR183 P32249 1/20 0.45
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HRH3 Q9Y5N1 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
SCHEMBL3869038 1.00 MEN1 (0.48) MEN1KMT2ACCR2LSSMCHR1
SCHEMBL3869882 0.78 MCHR1 (0.60) MEN1KMT2ALSSMCHR1HRH3
SCHEMBL3872969 0.76 MEN1 (0.47) MEN1KMT2ALSSMCHR1HTR2C
SCHEMBL3868658 0.74 CHRM4 (0.66) MEN1KMT2ALSSMCHR1HTR2C
SCHEMBL14500277 0.73 MCHR1 (0.52) CCR2MCHR1
SCHEMBL2927249 0.73 LSS (0.56) MEN1KMT2ALSSMCHR1HTR2C
Hydrochloric Acid SCHEMBL5419175 0.73 MCHR1 (0.52) CCR2MCHR1
Hydrochloric Acid SCHEMBL5419178 0.73 MCHR1 (0.52) CCR2MCHR1
SCHEMBL2925998 0.70 MCHR1 (0.77) MCHR1HTR2CCHRM4KDM4E
SCHEMBL28742815 0.70 HDAC1 (0.62) MEN1KMT2AMCHR1

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 MEN1 298/4885KMT2A 1130/4885CCR2 826/4885

“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.