SCHEMBL3872569

SCHEMBL3872569

CC(C)C(=O)Cc1ccc(C(=O)NCCc2ccc(C(C)N3CCCC3)cc2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.48
ESRRG P62508 1/20 0.44
OPRD1 P41143 1/20 0.43
NPC1 O15118 2/20 0.40
POLB P06746 1/20 0.40
HTR2A P28223 1/20 0.40
RAB9A P51151 1/20 0.40
KCNK3 O14649 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CNR1 P21554 1/20 0.37
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL3870963 0.86 MCHR1 (0.66) MCHR1ESRRGNPC1POLBHTR2A
SCHEMBL3867725 0.79 PARP10 (0.46) MCHR1ESRRG
SCHEMBL3871467 0.78 CHRM4 (0.44) MCHR1ESRRG
SCHEMBL6705763 0.75 OPRM1 (0.46) OPRD1NPC1POLBRAB9AALDH1A1
SCHEMBL3881228 0.74 MCHR1 (0.67) MCHR1NPC1HTR2ARAB9AALDH1A1
SCHEMBL3870762 0.73 MCHR1 (0.66) MCHR1NPC1HTR2ARAB9AALDH1A1
SCHEMBL3878626 0.73 MCHR1 (0.66) MCHR1NPC1HTR2ARAB9AALDH1A1
SCHEMBL3869095 0.73 ALDH1A1 (0.49) MCHR1NPC1POLBHTR2ARAB9A
SCHEMBL3872340 0.71 ALDH1A1 (0.58) MCHR1NPC1HTR2ARAB9AALDH1A1
SCHEMBL3868850 0.71 NPC1 (0.48) MCHR1ESRRGNPC1HTR2ARAB9A

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 4/4885ESRRG 1453/4885OPRD1 105/4885

“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.