SCHEMBL4240971

SCHEMBL4240971

CC(C)(Cc1ccc(Oc2ccc(N)cc2Cl)cc1F)OC(N)=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.40
SLC6A4 P31645 5/20 0.40
SCN9A Q15858 5/20 0.38
ESRRA P11474 2/20 0.37
PNLIP P16233 1/20 0.36
PDE7A Q13946 1/20 0.36
KCNH2 Q12809 3/20 0.36
SOS1 Q07889 1/20 0.36
PPARA Q07869 3/20 0.36
EPHX2 P34913 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 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
SCHEMBL4242192 0.86 PDE7A (0.52) PDE7A
SCHEMBL4228537 0.85 MAPT (0.37) HTR2ASLC6A4KCNH2PPARG
SCHEMBL4238713 0.85 PARP10 (0.41) SCN9ASOS1
SCHEMBL4233643 0.81 KDM4E (0.36) HTR2ASLC6A4SCN9A
SCHEMBL4228783 0.81 PKM (0.41) ESRRAPNLIP
SCHEMBL4238402 0.76 TBXA2R (0.39) PDE7A
SCHEMBL4232011 0.76 HSPB1 (0.39) PDE7A
SCHEMBL4232519 0.75 TDP1 (0.37)
SCHEMBL4237839 0.75 ALDH1A1 (0.44)
SCHEMBL27831631 0.74 NR1H4 (0.39) HTR2ASLC6A4KCNH2EPHX2NR1H4

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HTR2A 126/4885SLC6A4 438/4885SCN9A 1316/4885

“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.