Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2426715

CCCc1cccc(NC2CCNCC2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 1/20 0.44
▸ HRH4 Q9H3N8 2/20 0.44
▸ HRH3 Q9Y5N1 2/20 0.44
▸ DCUN1D1 Q96GG9 2/20 0.42
▸ PTPN1 P18031 1/20 0.40
▸ ITGB3 P05106 1/20 0.40
▸ ITGA2B P08514 1/20 0.40
▸ TPSAB1 Q15661 2/20 0.40
▸ UBE2M P61081 1/20 0.39
▸ MLNR O43193 2/20 0.39
▸ HTR6 P50406 2/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ DRD2 P14416 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR7 P34969 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CDK2 P24941 1/20 0.37
▸ CDK5 Q00535 1/20 0.37

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
Hydrochloric Acid SCHEMBL5178154 0.79 GNAI3 (0.43) ITGB3ITGA2BHTR6HTR1ADRD2
SCHEMBL2426719 0.78 KDM4E (0.43) DCUN1D1UBE2MMLNR
SCHEMBL17072657 0.77 SMN1; SMN2 (0.47) PTPN1HTR6HTR1ADRD2HTR2A
Trifluoroacetic Acid SCHEMBL2422738 0.77 HRH1 (0.57) —
Trifluoroacetic Acid SCHEMBL4691138 0.74 CACNA1B (0.54) CACNA1BHRH4HRH3HTR6SMN1; SMN2
Trifluoroacetic Acid SCHEMBL4690307 0.74 CACNA1B (0.54) CACNA1BHRH4HRH3HTR6SMN1; SMN2
SCHEMBL8548152 0.73 HTR6 (0.47) PTPN1HTR6HTR1ADRD2HTR2A
Trifluoroacetic Acid SCHEMBL6396756 0.73 CACNA1B (0.48) CACNA1BHRH4HRH3HTR6SMN1; SMN2
SCHEMBL30444517 0.71 GRIK1 (0.54) PTPN1HTR6HTR1ADRD2HTR2A
Trifluoroacetic Acid SCHEMBL5036144 0.71 CARM1 (0.47) DCUN1D1

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
US-8012995-B1 Pharmaceutically active sulfonamide derivatives MERCK SERONO SA (CH) 2011-09-06 — — US disclosed
EP-1218374-B1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2005-11-16 — — EP disclosed
EP-1218374-A1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES Applied Research Systems ARS Holding N.V. (AN) 2002-07-03 — — EP disclosed
WO-2001023378-A1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-05 — — WO disclosed
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