SCHEMBL3096469

SCHEMBL3096469

O=C(O)C1CC1c1ccc(-c2c[nH]c(C(F)(F)F)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.42
EPHX2 P34913 1/20 0.40
P2RY14 Q15391 2/20 0.39
TMEM97 Q5BJF2 1/20 0.39
FFAR4 Q5NUL3 3/20 0.38
CYP4F2 P78329 4/20 0.38
CYP4A11 Q02928 4/20 0.38
RXRA P19793 2/20 0.37
RXRB P28702 2/20 0.37
RXRG P48443 2/20 0.37
RARA P10276 1/20 0.37
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
S1PR1 P21453 1/20 0.36
S1PR3 Q99500 1/20 0.36
S1PR5 Q9H228 1/20 0.36

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
SCHEMBL14658591 0.75 FFAR1 (0.46) FFAR1FFAR4CYP4F2CYP4A11
SCHEMBL350985 0.72 APP (0.44)
SCHEMBL23425321 0.72 FFAR1 (0.54) FFAR1EPHX2P2RY14TMEM97RXRA
SCHEMBL1474431 0.72 FFAR1 (0.54) FFAR1EPHX2P2RY14TMEM97RXRA
SCHEMBL1799765 0.72 FFAR1 (0.54) FFAR1EPHX2P2RY14TMEM97RXRA
SCHEMBL1474653 0.72 FFAR1 (0.54) FFAR1EPHX2P2RY14TMEM97RXRA
SCHEMBL1795393 0.72 FFAR1 (0.54) FFAR1EPHX2P2RY14TMEM97RXRA
SCHEMBL20558894 0.70 RXRA (0.47) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL20558896 0.70 RXRA (0.47) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL25729018 0.69 PTPN1 (0.34)

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-20100256114-A1 Amido Compounds And Their Use As Pharmaceuticals INCYTE CORPORATION (US) 2010-10-07 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-20100256114-A1 Amido Compounds And Their Use As Pharmaceuticals HSD11B1, CYP11B1, HSD11B2 FFAR1 419/4885EPHX2 788/4885P2RY14 2401/4885

“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.