SCHEMBL17355657

SCHEMBL17355657

CC(=O)C(=O)Oc1ccc(F)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 1/20 0.45
▸ IDO1 P14902 2/20 0.38
▸ RBP4 P02753 2/20 0.36
▸ TTR P02766 1/20 0.36
▸ ATM Q13315 2/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ KIF11 P52732 1/20 0.36
▸ RXRA P19793 2/20 0.35
▸ RXRB P28702 2/20 0.35
▸ RXRG P48443 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CRHR1 P34998 1/20 0.34
▸ P2RY1 P47900 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
SCHEMBL17355817 0.90 MRGPRX4 (0.49) MRGPRX4IDO1RBP4TTRATM
SCHEMBL3325352 0.87 MRGPRX4 (0.47) MRGPRX4IDO1RBP4TTRATM
SCHEMBL17355793 0.86 MRGPRX4 (0.44) MRGPRX4IDO1RBP4TTRCYP2C19
SCHEMBL18697296 0.81 MRGPRX4 (0.48) MRGPRX4IDO1RBP4TTRATM
SCHEMBL3420669 0.81 ATM (0.47) MRGPRX4ATMKMT2APPARGRXRA
SCHEMBL17355763 0.81 MRGPRX4 (0.45) MRGPRX4IDO1RBP4TTRPPARG
SCHEMBL17355661 0.79 MRGPRX4 (0.41) MRGPRX4IDO1RBP4TTRATM
SCHEMBL17355824 0.79 MRGPRX4 (0.46) MRGPRX4IDO1RBP4TTRKMT2A
SCHEMBL17355820 0.79 MRGPRX4 (0.49) MRGPRX4IDO1RBP4TTRPPARG
SCHEMBL12805307 0.76 MRGPRX4 (0.53) MRGPRX4IDO1RBP4TTRRXRA

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-20150372349-A1 NON-AQUEOUS ELECTROLYTE AND ELECTRICITY STORAGE DEVICE UBE INDUSTRIES, LTD. (JP) 2015-12-24 — — US disclosed
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 4355/4885IDO1 4571/4885RBP4 2368/4885

“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.

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