SCHEMBL16240380

SCHEMBL16240380

O=C(O)c1cc2c(C(F)(F)F)cc(-c3ccccc3OC(F)(F)F)cc2n1O

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 5/20 0.69
▸ DHODH Q02127 1/20 0.41
▸ FFAR4 Q5NUL3 1/20 0.40
▸ SCN9A Q15858 9/20 0.39
▸ SCN10A Q9Y5Y9 1/20 0.39
▸ SCN5A Q14524 1/20 0.39
▸ HSD11B1 P28845 1/20 0.38
▸ CTSA P10619 1/20 0.38
▸ DAO P14920 1/20 0.37

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
SCHEMBL16240929 0.88 LDHA (0.71) LDHADHODHSCN9ASCN10ASCN5A
SCHEMBL7624 0.82 LDHA (1.00) LDHADAO
SCHEMBL16240438 0.81 LDHA (0.73) LDHADHODHSCN5A
SCHEMBL16240015 0.80 LDHA (0.72) LDHADHODHFFAR4
SCHEMBL16240396 0.79 LDHA (0.67) LDHADAO
SCHEMBL16240391 0.75 LDHA (0.65) LDHADHODHDAO
SCHEMBL12838 0.75 LDHA (0.65) LDHAHSD11B1
SCHEMBL8149 0.74 LDHA (0.79) LDHADHODHDAO
SCHEMBL16240013 0.73 LDHA (0.74) LDHADAO
SCHEMBL16240296 0.72 LDHA (0.71) LDHA

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-20140343001-A1 INDOLE DERIVATIVES INHIBITORS OF ENZYME LACTATE DEHYDROGENASE (LDH) UNIVERSITA DI PISA (IT) 2014-11-20 — — US claimed
US-20140343001-A1 INDOLE DERIVATIVES INHIBITORS OF ENZYME LACTATE DEHYDROGENASE (LDH) UNIVERSITA DI PISA (IT) 2014-11-20 — — 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-20140343001-A1 INDOLE DERIVATIVES INHIBITORS OF ENZYME LACTATE DEHYDROGENASE (LDH) LDHA, LDHB, IDO1 LDHA 1/4885DHODH 22/4885FFAR4 2355/4885

“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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