SCHEMBL3869748

SCHEMBL3869748

O=C(COc1ccc(CN2CCCC2)cc1)Nc1ccc(-c2ccc(Cl)cc2)cc1

nearest known ligand 0.98

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 5/20 0.98
MCHR1 Q99705 5/20 0.98
HTR2A P28223 4/20 0.98
GAA P10253 2/20 0.73
ACHE P22303 1/20 0.66
POLB P06746 3/20 0.62
ALDH1A1 P00352 2/20 0.62
USP2 O75604 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.58
LMNA P02545 1/20 0.58
HRH3 Q9Y5N1 1/20 0.57
KDM4E B2RXH2 1/20 0.56
MAPK1 P28482 1/20 0.56

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
SCHEMBL4014334 0.99 CHRM1 (1.00) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3868226 0.86 CHRM1 (0.74) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3867716 0.86 ACHE (0.82) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3878387 0.86 GAA (0.76) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3875726 0.84 MCHR1 (0.71) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3869970 0.84 KDM4E (0.74) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3869862 0.84 MCHR1 (0.71) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3872703 0.83 CHRM1 (0.70) CHRM1MCHR1HTR2AGAAACHE
SCHEMBL3875635 0.83 MCHR1 (0.69) CHRM1MCHR1HTR2AGAAPOLB
SCHEMBL3867601 0.82 MCHR1 (0.68) CHRM1MCHR1HTR2AGAAACHE

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 CHRM1 217/4885MCHR1 4/4885HTR2A 94/4885

“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.