SCHEMBL17355661

SCHEMBL17355661

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ ESR1 P03372 1/20 0.39
▸ MAOB P27338 3/20 0.37
▸ MAPT P10636 3/20 0.36
▸ HPGD P15428 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ IDO1 P14902 2/20 0.35
▸ RBP4 P02753 1/20 0.34
▸ TTR P02766 1/20 0.34
▸ ATM Q13315 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ NR3C2 P08235 1/20 0.33
▸ LMNA P02545 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
SCHEMBL17355824 0.93 MRGPRX4 (0.46) MRGPRX4ESR1MAOBMAPTHPGD
SCHEMBL3325352 0.82 MRGPRX4 (0.47) MRGPRX4ESR1MAPTHPGDKDM4E
SCHEMBL17355827 0.80 KDM4E (0.45) MRGPRX4ESR1MAOBMAPTHPGD
SCHEMBL17355657 0.79 MRGPRX4 (0.45) MRGPRX4HPGDKDM4EHSD17B10KMT2A
SCHEMBL17355817 0.78 MRGPRX4 (0.49) MRGPRX4KDM4EKMT2AIDO1RBP4
SCHEMBL18697296 0.77 MRGPRX4 (0.48) MRGPRX4KDM4EKMT2AIDO1RBP4
SCHEMBL17355829 0.76 KMT2A (0.49) MRGPRX4MAOBMAPTHPGDKDM4E
SCHEMBL17355763 0.76 MRGPRX4 (0.45) MRGPRX4MAPTHPGDKDM4EHSD17B10
SCHEMBL17355670 0.75 MAOB (0.43) ESR1MAOBMAPTSLC6A4
SCHEMBL17355793 0.75 MRGPRX4 (0.44) MRGPRX4IDO1RBP4TTRNR3C1

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 4355/4885ESR1 334/4885MAOB 3090/4885

“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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