SCHEMBL17356454

SCHEMBL17356454

COC(=O)C(=O)Oc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 13/20 0.51
MAPT P10636 1/20 0.48
FFAR1 O14842 2/20 0.46
GPR35 Q9HC97 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL17356416 0.86 MRGPRX4 (0.52) MRGPRX4MAPTFFAR1CYP1A2CYP3A4
SCHEMBL17356510 0.83 CFTR (0.44) MRGPRX4MAPTGPR35CYP1A2CYP2C9
SCHEMBL5769694 0.83 KDM4E (0.60) MRGPRX4FFAR1CYP2C19
SCHEMBL5277735 0.82 MRGPRX4 (0.51) MRGPRX4FFAR1
SCHEMBL17356507 0.80 KDM4E (0.47) MAPTGPR35CYP1A2CYP2C9CYP2C19
SCHEMBL3712182 0.80 MRGPRX4 (0.53) MRGPRX4MAPTFFAR1
SCHEMBL17356479 0.80 GPR35 (0.53) MAPTGPR35CYP1A2CYP3A4CYP2C9
SCHEMBL17355797 0.78 MRGPRX4 (0.43) MRGPRX4MAPTCYP2C9CYP2C19
SCHEMBL1688243 0.77 MAPT (0.50) MRGPRX4MAPTFFAR1CYP1A2CYP3A4
SCHEMBL3860646 0.76 FFAR1 (0.49) MRGPRX4FFAR1

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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE HCN2, SCO2, HCN1 MRGPRX4 4355/4885MAPT 4452/4885FFAR1 724/4885

“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.