SCHEMBL3870145

SCHEMBL3870145

CN1CCN(Cc2ccc(CCNC(=O)c3ccc(OCCC4CC4)cc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
KDM4E B2RXH2 1/20 0.56
CHRM4 P08173 2/20 0.53
HDAC6 Q9UBN7 1/20 0.51
MCHR1 Q99705 6/20 0.50
CHRM1 P11229 3/20 0.50
HTR2A P28223 3/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP2D6 P10635 2/20 0.49
MAPT P10636 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
ACHE P22303 1/20 0.48

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
SCHEMBL3868263 0.91 MCHR1 (0.60) SMN1; SMN2KDM4ECHRM4MCHR1CHRM1
SCHEMBL3871958 0.90 MCHR1 (0.61) SMN1; SMN2KDM4ECHRM4MCHR1CHRM1
SCHEMBL3869115 0.90 SMN1; SMN2 (0.59) SMN1; SMN2KDM4ECHRM4HDAC6MCHR1
SCHEMBL3868882 0.90 MCHR1 (0.61) SMN1; SMN2KDM4ECHRM4MCHR1CHRM1
SCHEMBL3879838 0.85 KDM4E (0.57) SMN1; SMN2KDM4EHDAC6MCHR1CHRM1
SCHEMBL3881255 0.85 CHRM4 (0.57) SMN1; SMN2KDM4ECHRM4MCHR1NPC1
SCHEMBL3875592 0.83 KDM4E (0.59) SMN1; SMN2KDM4EHDAC6MCHR1CHRM1
SCHEMBL3870981 0.83 HRH3 (0.52) SMN1; SMN2KDM4ECHRM4MCHR1NPC1
SCHEMBL3871674 0.82 NPC1 (0.49) SMN1; SMN2KDM4ECHRM4NPC1RAB9A
SCHEMBL3868656 0.82 NPC1 (0.67) SMN1; SMN2KDM4ECHRM4NPC1RAB9A

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 SMN1; SMN2 2397/4885KDM4E 1415/4885CHRM4 757/4885

“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.