Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL27202992

Cc1nc(C(=O)NC2COC2)ccc1N1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.46
▸ HRH4 Q9H3N8 2/20 0.39
▸ USP28 Q96RU2 7/20 0.39
▸ USP25 Q9UHP3 4/20 0.39
▸ SCN9A Q15858 2/20 0.38
▸ HPGDS O60760 1/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.37
▸ PARP1 P09874 1/20 0.36
▸ ADORA2A P29274 1/20 0.36

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
SCHEMBL30064390 0.85 SCN9A (0.43) USP28USP25SCN9AHPGDSPARP1
SCHEMBL29085170 0.85 SCN9A (0.43) USP28USP25SCN9AHPGDSPARP1
SCHEMBL29085174 0.85 SCN9A (0.43) USP28USP25SCN9AHPGDSPARP1
SCHEMBL29085217 0.83 ALDH1A1 (0.39) BACE1USP28USP25PARP1
SCHEMBL25235207 0.83 PARP1 (0.45) USP28USP25HPGDSPARP1
SCHEMBL30273150 0.83 PARP1 (0.45) USP28USP25HPGDSPARP1
SCHEMBL31514765 0.82 PARP1 (0.43) BACE1SCN9AHPGDSPARP1
Hydrochloric Acid SCHEMBL31552839 0.82 PARP1 (0.44) USP28USP25HPGDSPARP1
SCHEMBL29085237 0.81 TYK2 (0.39) BACE1USP28USP25SCN9APARP1
SCHEMBL30064539 0.79 SCN9A (0.42) USP28USP25SCN9AHPGDSPARP1

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-20240132449-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. 2024-04-25 — — US disclosed
WO-2024050370-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-03-07 — — 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-20240132449-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF PARP1, PARP11, PARP12 BACE1 1468/4885HRH4 3356/4885USP28 2951/4885

“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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