SCHEMBL4474709

SCHEMBL4474709

O=C(Nc1ccc(CN2CCCCC2)cc1)c1[nH]c2ccc(OCc3ccccc3)cc2c1OC(=O)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
LMNA P02545 3/20 0.51
HTT P42858 2/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPK1 P28482 1/20 0.49
HRH3 Q9Y5N1 10/20 0.48
FAAH O00519 1/20 0.45
GAA P10253 1/20 0.44
GSK3B P49841 1/20 0.44
PRKAA2 P54646 1/20 0.43

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
SCHEMBL4466681 0.99 SMN1; SMN2 (0.49) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4465734 0.90 GSK3B (0.49) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4473787 0.84 SMN1; SMN2 (0.45) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4475209 0.84 KDM4E (0.41) SMN1; SMN2LMNAHTTRAB9AKDM4E
SCHEMBL4461647 0.82 SMN1; SMN2 (0.43) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4482193 0.81 MAPT (0.43) SMN1; SMN2LMNAHTTNPC1RAB9A
Trifluoroacetic Acid SCHEMBL4474703 0.79 SMN1; SMN2 (0.53) SMN1; SMN2LMNAHTTNPC1RAB9A
Trifluoroacetic Acid SCHEMBL4466676 0.79 KDM4E (0.52) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4466439 0.77 SMN1; SMN2 (0.58) SMN1; SMN2LMNAHTTNPC1RAB9A
SCHEMBL4482778 0.77 MAPT (0.43) SMN1; SMN2LMNAHTTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531668-B2 2-arylcarboxamide-nitrogenous heterocycle compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-05-12 US disclosed
US-20070299070-A1 2-Arylcarboxamide-Nitrogenous Heterocycle Compound MSD K.K. (JP) 2007-12-27 US disclosed
EP-1798221-A1 2-ARYLCARBOXAMIDE-NITROGENEOUS HETEROCYCLE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-06-20 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-20070299070-A1 2-Arylcarboxamide-Nitrogenous Heterocycle Compound MCHR2, MCHR1, NPY2R SMN1; SMN2 4352/4885LMNA 3898/4885HTT 857/4885

“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.