SCHEMBL5482157

SCHEMBL5482157

CC1Oc2ccc(C(N)(CCCCNC(=O)C(F)(F)F)C(=O)OC(C)(C)C)cc2N=C1N

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA14 Q9ULX7 1/20 0.33
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL5466884 0.99 CA14 (0.32) CA14
SCHEMBL6310050 0.88 CA1 (0.34)
SCHEMBL5476928 0.88 NAAA (0.35)
SCHEMBL6281732 0.87
SCHEMBL5467315 0.86 CYP1A2 (0.35) ALDH1A1POLBSMN1; SMN2
SCHEMBL5467574 0.85 HDAC3 (0.35) ALDH1A1POLBSMN1; SMN2
SCHEMBL5468706 0.85
SCHEMBL5473214 0.84 DRD2 (0.30)
SCHEMBL6608613 0.81 GBA1 (0.30)
SCHEMBL6310057 0.78

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-20070049583-A1 Benzoxazine and benzothiazine derivatives and their use in pharmaceutical agents SCHERING AKTIENGESELLSCHAFT (DE) 2007-03-01 US disclosed
US-7141566-B1 Benzoxazine and benzothiazine derivatives and the use thereof in medicaments SCHERING AKTIENGESELLSCHAFT (DE) 2006-11-28 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-20070049583-A1 Benzoxazine and benzothiazine derivatives and their use in pharmaceutical agents CYP3A5, XDH, CYP4Z1 CA14 2410/4885ALDH1A1 869/4885POLB 2443/4885

“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.