SCHEMBL4600254

SCHEMBL4600254

O=Cc1cc(-c2ccc(Cl)cc2F)ccc1OC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.40
EPAS1 Q99814 1/20 0.38
ANO1 Q5XXA6 1/20 0.37
ALOX5AP P20292 3/20 0.36
FEN1 P39748 3/20 0.36
RORC P51449 1/20 0.35
LCLAT1 Q6UWP7 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CTSA P10619 1/20 0.35
XDH P47989 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
FFAR4 Q5NUL3 1/20 0.33
DHODH Q02127 1/20 0.33

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
SCHEMBL5622385 0.88 TDP1 (0.42) ERN1EPAS1ANO1RORCTDP1
SCHEMBL5620852 0.86 PIM1 (0.43) ERN1EPAS1ALOX5APFEN1PDE3B
SCHEMBL5622410 0.83 ERN1 (0.48) ERN1EPAS1ANO1TDP1DHODH
SCHEMBL32682731 0.83 ERN1 (0.47) ERN1EPAS1ANO1TDP1FFAR4
SCHEMBL20303480 0.83 ERN1 (0.47) ERN1EPAS1ANO1TDP1FFAR4
SCHEMBL868292 0.83 EPAS1 (0.40) ERN1EPAS1ALOX5APFEN1CTSA
SCHEMBL4598990 0.82 ERN1 (0.40) ERN1EPAS1ALOX5APFEN1CTSA
SCHEMBL4599847 0.81 SCN10A (0.38) ERN1EPAS1ALOX5APFEN1RORC
SCHEMBL14499532 0.80 FFAR1 (0.44) ANO1ALOX5APFEN1RORCCTSA
SCHEMBL868189 0.76 ERN1 (0.62) ERN1

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
EP-1910292-A1 PIPERIDINE DERIVATIVE AS TACHYKININ RECEPTOR ANTAGONIST Takeda Pharmaceutical Company Limited (JP) 2008-04-16 EP disclosed
US-20070149570-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 US disclosed
US-20070149570-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 US disclosed
US-20070149570-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 US disclosed
WO-2007015588-A1 PIPERIDINE DERIVATIVE AS TACHYKININ RECEPTOR ANTAGONIST TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-08 WO 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-20070149570-A1 Piperidine derivative and use thereof TACR1, OPRL1, TRPV1 ERN1 4124/4885EPAS1 1676/4885ANO1 1037/4885

“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.