Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL22533899

COC(=O)c1ccc2ncn(Cc3ccc(B(O)O)cc3)c2c1.O=C(O)C(F)(F)F

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.54
▸ MMP13 P45452 2/20 0.44
▸ CDK9 P50750 2/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ CNR1 P21554 1/20 0.41
▸ FLT3 P36888 1/20 0.40
▸ FGFR1 P11362 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ YTHDC1 Q96MU7 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39

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
Trifluoroacetic Acid SCHEMBL29424853 1.00 BRD4 (0.54) BRD4MMP13CDK9HDAC1HDAC6
SCHEMBL22533663 0.93 BRD4 (0.57) BRD4MMP13CDK9HDAC1HDAC6
SCHEMBL29424736 0.93 BRD4 (0.57) BRD4MMP13CDK9HDAC1HDAC6
Trifluoroacetic Acid SCHEMBL22533756 0.92 BRD4 (0.49) BRD4MMP13HDAC1HDAC6FGFR1
Trifluoroacetic Acid SCHEMBL22533411 0.89 MEN1 (0.44) BRD4MMP13CDK9HDAC1HDAC6
SCHEMBL22533901 0.87 BRD4 (0.53) BRD4MMP13CDK9HDAC1HDAC6
SCHEMBL22533413 0.87 BRD4 (0.45) BRD4CDK9HDAC1HDAC6CNR1
Trifluoroacetic Acid SCHEMBL22533911 0.87 HDAC1 (0.44) BRD4MMP13CDK9HDAC1HDAC6
Trifluoroacetic Acid SCHEMBL29424806 0.87 HDAC1 (0.44) BRD4MMP13CDK9HDAC1HDAC6
SCHEMBL22533917 0.84 BRD4 (0.52) BRD4MMP13HDAC1HDAC6FGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors RIBOSCIENCE LLC (US) 2024-07-09 — — US disclosed
EP-4249070-A2 BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS Riboscience LLC (US) 2023-09-27 — — EP disclosed
EP-3952995-B1 BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2023-09-20 — — EP disclosed
EP-3952995-A1 BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS Riboscience LLC (US) 2022-02-16 — — EP disclosed
CN-114040915-A Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors 里伯赛恩斯有限责任公司 2022-02-11 — — CN disclosed
WO-2020210649-A1 BICYCLIC HETEROARYL DERIVATIVES AS ECTONUCLEOTIDE PYROPHOSPHATASE PHOSPHODIESTERASE 1 INHIBITORS RIBOSCIENCE LLC (US) 2020-10-15 — — 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-12029744-B2 Bicyclic heteroaryl derivatives as ectonucleotide pyrophosphatase phosphodiesterase 1 inhibitors ENPP1, ENPP3, SMPD1 BRD4 1627/4885MMP13 2543/4885CDK9 972/4885

“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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