Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL521248

CSc1ncc2ccc(-c3ccc[nH]3)n2n1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4C Q9H3R0 1/20 0.30
IRAK4 Q9NWZ3 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
SCHEMBL521268 0.89 KDM4E (0.32) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL519714 0.70 KDM4E (0.52) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL521646 0.70 JAK2 (0.38) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL521852 0.69 AURKA (0.42) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL19876452 0.68 KDM4E (0.43) KDM4EALDH1A1HPGDSMN1; SMN2IRAK4
SCHEMBL520503 0.68 INSR (0.42) KDM4EALDH1A1HPGDSMN1; SMN2KDM4C
SCHEMBL521590 0.66 EGLN2 (0.40) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL521339 0.66 FYN (0.41)
SCHEMBL520458 0.65 HSP90AA1 (0.42)
SCHEMBL519998 0.65 ABCG2 (0.40) KDM4EALDH1A1HPGDSMN1; SMN2

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-2376491-B1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON INC (US) 2015-03-04 EP disclosed
US-8471005-B2 Pyrrolotriazines as ALK and JAK2 inhibitors CEPHALON, INC. (US) 2013-06-25 US disclosed
US-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 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-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS JAK2, ALK, ABL1 KDM4E 192/4885ALDH1A1 779/4885HPGD 3064/4885

“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.