SCHEMBL1749815

SCHEMBL1749815

N#Cc1c(N2CCC(CNC(=O)O)C2)ccc(N)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
CHRM4 P08173 5/20 0.39
RPS6KB1 P23443 4/20 0.38
USP30 Q70CQ3 5/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
NOTUM Q6P988 1/20 0.36
CHRM2 P08172 2/20 0.35
CHRM1 P11229 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL1749516 0.81 NOTUM (0.40) RPS6KB1MEN1ALDH1A1LMNAMAPT
SCHEMBL1750584 0.80 CHRM4 (0.41) GAACHRM4RPS6KB1USP30LMNA
SCHEMBL1749741 0.78 RPS6KB1 (0.40) RPS6KB1USP30MEN1ALDH1A1LMNA
SCHEMBL1749472 0.78 RPS6KB1 (0.48) RPS6KB1ALDH1A1MAPTNOTUMTDP1
SCHEMBL6792106 0.76 MAPT (0.42) GAACHRM4USP30MEN1ALDH1A1
SCHEMBL1749817 0.75 GAA (0.41) GAARPS6KB1USP30NOTUMTDP1
SCHEMBL1748829 0.73 DRD2 (0.45) MEN1ALDH1A1LMNAMAPTMAPK1
SCHEMBL1749834 0.73 P2RX7 (0.46) MEN1ALDH1A1LMNAMAPTMAPK1
SCHEMBL1749401 0.73 MAPT (0.46) GAARPS6KB1MEN1ALDH1A1LMNA
SCHEMBL1749277 0.72 CHRM4 (0.40) GAACHRM4RPS6KB1MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20040220191-A1 Substituted N-aryl heterocycles, process for their preparation and their use as medicaments CYP11B2, CYP11B1, CYP1A1 GAA 1379/4885CHRM4 2150/4885RPS6KB1 3306/4885

“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.