SCHEMBL4385745

SCHEMBL4385745

NOCc1nc2cc(F)ccc2n1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 12/20 0.43
AGTR1 P30556 1/20 0.41
AGTR2 P50052 1/20 0.41
CPT1A P50416 1/20 0.41

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
SCHEMBL13588903 0.83 TBXA2R (0.41) TBXA2RAGTR1AGTR2
SCHEMBL4552217 0.82 TBXA2R (0.48) TBXA2RAGTR1AGTR2CPT1A
SCHEMBL4376876 0.69 MEN1 (0.44) TBXA2R
SCHEMBL4385302 0.67 TBXA2R (0.46) TBXA2RAGTR1AGTR2
SCHEMBL20593183 0.64 TBXA2R (0.37) TBXA2R
SCHEMBL9847736 0.64 AGTR1 (0.53) TBXA2RAGTR1AGTR2
SCHEMBL6126109 0.63 TSHR (0.48)
SCHEMBL5107769 0.62 TBXA2R (0.48) TBXA2R
SCHEMBL6738367 0.62 AGTR1 (0.40) TBXA2RAGTR1AGTR2
SCHEMBL4552025 0.61 KMT2A (0.40) TBXA2R

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2009-12-03 US disclosed
EP-2040698-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2009-04-01 EP disclosed
WO-2008008398-A2 OXIME COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-01-17 WO 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-20090298878-A1 OXIME COMPOUNDS AND THE USE THEREOF KCNN4, CACNA1A, KCNN3 TBXA2R 328/4885AGTR1 568/4885AGTR2 519/4885

“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.