Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29364340

Cc1nc(-c2c[nH]c3c(C#N)cccc23)ccc1NC1CCNC1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CCNT1 O60563 13/20 0.51
▸ CCNK O75909 13/20 0.51
▸ CDK9 P50750 13/20 0.51
▸ CDK12 Q9NYV4 13/20 0.51
▸ CCNE1 P24864 12/20 0.51
▸ CDK2 P24941 12/20 0.51
▸ IRAK4 Q9NWZ3 3/20 0.41
▸ NFATC1 O95644 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ CDK7 P50613 7/20 0.41
▸ CCNH P51946 7/20 0.41
▸ MNAT1 P51948 4/20 0.40
▸ HRH4 Q9H3N8 1/20 0.39
▸ HRH3 Q9Y5N1 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
SCHEMBL25028765 0.91 CCNT1 (0.52) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29363458 0.84 CCNT1 (0.59) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29363835 0.84 CCNT1 (0.46) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29361498 0.80 CCNT1 (0.42) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL25028778 0.79 CCNT1 (0.53) CCNT1CCNKCDK9CDK12CCNE1
SCHEMBL29361385 0.79 CCNT1 (0.53) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29361361 0.79 CCNT1 (0.48) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29005531 0.79 HRH4 (0.41) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL25247543 0.77 GSK3B (0.43) CCNT1CCNKCDK9CDK12CCNE1
Trifluoroacetic Acid SCHEMBL29363990 0.77 GSK3B (0.43) CCNT1CCNKCDK9CDK12CCNE1

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
EP-4182320-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Nido Biosciences, Inc. (US) 2023-05-24 — — EP disclosed
WO-2022020342-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2022-01-27 — — WO disclosed
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