Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21828450

Cc1c2c(c(C)c(-c3ccccc3)c1-c1ccccc1)C(=O)N(CCN)C2=O.O=C(O)C(F)(F)F

nearest known ligand 0.36

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 1/20 0.36
▸ HEXA P06865 1/20 0.36
▸ HEXB P07686 1/20 0.36
▸ GNRHR P30968 8/20 0.36
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ BACE1 P56817 2/20 0.35
▸ CASP3 P42574 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CDK8 P49336 1/20 0.34
▸ ACVR1 Q04771 1/20 0.34

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
SCHEMBL18919411 0.89 HEXA (0.44) LCKHEXAHEXBCDK8ACVR1
Trifluoroacetic Acid SCHEMBL30131250 0.78 ALDH1A1 (0.52) HEXAHEXBGNRHRBACE1
SCHEMBL21909057 0.77 HEXA (0.47) LCKHEXAHEXB
SCHEMBL18942615 0.75 POLB (0.46) CASP3POLB
SCHEMBL21828451 0.75 GNRHR (0.32) GNRHRCASP3POLB
Hydrochloric Acid SCHEMBL18919464 0.74 POLB (0.45) CASP3POLB
SCHEMBL18919421 0.74 GAA (0.41) CASP3POLB
SCHEMBL18919446 0.72 SMN1; SMN2 (0.47) CASP3POLB
SCHEMBL21909067 0.71 CDK8 (0.36) LCKCASP3CDK8ACVR1
Trifluoroacetic Acid SCHEMBL8142428 0.70 HEXA (0.56) HEXAHEXB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110914240-B Norbornenone compounds releasing carbon monoxide 奥塔哥创新有限公司 2024-02-20 — — CN disclosed
EP-3383846-B1 CARBON MONOXIDE RELEASING NORBORNENONE COMPOUNDS OTAGO INNOVATION LTD (NZ) 2022-06-22 — — EP disclosed
US-11072584-B2 Carbon monoxide releasing norbornenone compounds OTAGO INNOVATION LIMITED (NZ) 2021-07-27 — — US disclosed
US-20200109115-A1 CARBON MONOXIDE RELEASING NORBORNENONE COMPOUNDS AUCKLAND UNISERVICES LIMITED (NZ) 2020-04-09 — — 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 (2 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-20200109115-A1 CARBON MONOXIDE RELEASING NORBORNENONE COMPOUNDS HMOX1, MB, NOS2 LCK 1936/4885HEXA 1682/4885HEXB 1159/4885
US-11072584-B2 Carbon monoxide releasing norbornenone compounds HMOX1, MB, NOS2 LCK 1936/4885HEXA 1682/4885HEXB 1159/4885

“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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