SCHEMBL3780705

SCHEMBL3780705

N[C@H]1Cc2cc(-c3cccc(C(F)(F)F)c3)ccc2N(O)C1=O

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 17/20 0.75
KYAT1 Q16773 2/20 0.52
KYAT3 Q6YP21 2/20 0.52
GOT1 P17174 1/20 0.52
KDM1A O60341 1/20 0.45
PARP10 Q53GL7 1/20 0.44
PARP11 Q9NR21 1/20 0.44

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
SCHEMBL3773950 0.91 AADAT (0.64) AADATKYAT1KYAT3GOT1KDM1A
SCHEMBL16613035 0.86 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL3780430 0.86 AADAT (1.00) AADATKYAT1KYAT3GOT1
SCHEMBL3768773 0.84 AADAT (0.58) AADATKYAT1KYAT3GOT1
SCHEMBL3781818 0.83 AADAT (0.66) AADATKYAT1KYAT3GOT1
SCHEMBL6763356 0.83 AADAT (0.73) AADATKYAT1KYAT3GOT1
SCHEMBL3769057 0.83 AADAT (0.57) AADATKYAT1KYAT3GOT1
SCHEMBL3779884 0.81 AADAT (0.73) AADATKYAT1KYAT3GOT1
SCHEMBL3784044 0.81 AADAT (0.73) AADATKYAT1KYAT3GOT1
SCHEMBL3774782 0.80 AADAT (0.62) AADATKYAT1KYAT3GOT1KDM1A

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
EP-2443092-B1 BICYCLIC AND TRICYCLIC COMPOUNDS AS KAT II INHIBITORS PFIZER (US) 2015-04-08 EP disclosed
US-8183238-B2 Bicyclic and tricyclic compounds as KAT II inhibitors PFIZER INC. (US) 2012-05-22 US disclosed
US-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors PFIZER INC 2010-12-23 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-20100324043-A1 Bicyclic And Tricyclic Compounds As KAT II Inhibitors KAT2A, KAT2B, KAT6B AADAT 2284/4885KYAT1 69/4885KYAT3 129/4885

“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.