SCHEMBL10278734

SCHEMBL10278734

O=C(O)C1CC(c2ccc(OC(F)F)cc2)CN(C(=O)N2CCC(O)C2)C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2R P25116 5/20 0.43
ALDH1A1 P00352 5/20 0.37
HTT P42858 2/20 0.37
TSHR P16473 1/20 0.35
MDM2 Q00987 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KMT2A Q03164 2/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
CNR1 P21554 1/20 0.35
TMEM97 Q5BJF2 1/20 0.35
MEN1 O00255 1/20 0.34

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
SCHEMBL10278941 0.92 ALDH1A1 (0.38) F2RALDH1A1HTTTSHRMDM2
SCHEMBL10278942 0.90 F2R (0.43) F2RALDH1A1HTTTSHRMDM2
SCHEMBL642019 0.86 F2R (0.51) F2RKMT2AHRH3CNR1TMEM97
SCHEMBL1055593 0.84 F2R (0.40) F2RALDH1A1HTTTSHRMDM2
SCHEMBL1055592 0.84 F2R (0.47) F2RALDH1A1HTTKMT2ACNR1
SCHEMBL1056811 0.83 ALDH1A1 (0.35) F2RALDH1A1HTTTSHRMDM2
SCHEMBL10278542 0.81 LMNA (0.39) F2RALDH1A1HTTTSHRMDM2
SCHEMBL641909 0.81 F2R (0.54) F2RKMT2AHRH3CNR1TMEM97
SCHEMBL641277 0.78 F2R (0.48) F2RKMT2AHRH3CNR1TMEM97
SCHEMBL641596 0.77 F2R (0.68) F2RTSHRGAAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119663-B2 Heteroaryl-substituted piperidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-02-21 US disclosed
US-20090306139-A1 HETEROARYL-SUBSTITUTED PIPERIDINES BAYER HEALTHCARE AG (DE) 2009-12-10 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-20090306139-A1 HETEROARYL-SUBSTITUTED PIPERIDINES VHL, PIGO, PLIN3 F2R 698/4885ALDH1A1 609/4885HTT 878/4885

“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.