SCHEMBL1749378

SCHEMBL1749378

O=C(O)NC[C@H]1CCN(c2ccc(NC(=O)N3CCC(c4ccc(Cl)cc4)CC3)cn2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
TP53 P04637 3/20 0.48
LMNA P02545 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALOX5 P09917 1/20 0.47
HTR2C P28335 1/20 0.47
MCHR1 Q99705 1/20 0.47
KDM4E B2RXH2 1/20 0.44
CHRM4 P08173 1/20 0.44
NAMPT P43490 1/20 0.43
PANK3 Q9H999 2/20 0.43
IDO1 P14902 2/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL1749761 1.00 MAPT (0.48) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749653 0.86 MAPT (0.56) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749655 0.86 MAPT (0.56) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749089 0.82 MAPT (0.57) MAPTTP53LMNANPC1RAB9A
SCHEMBL14500998 0.82 MCHR1 (0.55) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749379 0.81 MAPT (0.48) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749586 0.80 MCHR1 (0.51) MAPTRAB9AMCHR1NAMPTFASN
SCHEMBL1749001 0.79 MCHR1 (0.49) MAPTTP53LMNANPC1RAB9A
SCHEMBL1749395 0.77 HAO1 (0.40) RAB9ASMN1; SMN2MCHR1KDM4EALDH1A1
SCHEMBL12528097 0.75 LCK (0.46) MAPTTP53LMNANPC1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968550-B2 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2011-06-28 US disclosed
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-09-06 US disclosed
US-7223788-B2 therapy for eating disorders, anorexigenic agents, antidiabetic agents, reducing weight in mammals, circadian rhythm disease, psychological disorders SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-29 US disclosed
US-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-11-04 US 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 (2 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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 MAPT 4824/4885TP53 4123/4885LMNA 2677/4885
US-20070207991-A1 Substituted N-aryl Heterocycles, Process For Their Preparation and Their Use As Medicaments CYP11B2, CYP11B1, NQO1 MAPT 4800/4885TP53 4172/4885LMNA 2573/4885

“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.