Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5734600

C=CC1CNCCN1c1ccccc1C.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 15/20 0.40
HTR2B P41595 14/20 0.40
HTR2A P28223 9/20 0.40
ADRB1 P08588 1/20 0.39
C1S P09871 1/20 0.36
TACR1 P25103 1/20 0.36
AR P10275 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
Trifluoroacetic Acid SCHEMBL5631600 1.00 HTR2C (0.40) HTR2CHTR2BHTR2AADRB1C1S
SCHEMBL5632697 0.88 ADRB1 (0.49) HTR2CHTR2BHTR2AADRB1
SCHEMBL5630914 0.88 ADRB1 (0.49) HTR2CHTR2BHTR2AADRB1
SCHEMBL5630920 0.88 ADRB1 (0.49) HTR2CHTR2BHTR2AADRB1
Trifluoroacetic Acid SCHEMBL5632354 0.86 KDM1A (0.36) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL5632499 0.86 KDM1A (0.36) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL5631588 0.83 HTR2C (0.41) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL5632974 0.78 HTR2C (0.38) HTR2CHTR2BHTR2ATACR1
SCHEMBL4430749 0.77 HTR2C (0.49) HTR2CHTR2BHTR2A
Trifluoroacetic Acid SCHEMBL5631649 0.76 HTR2C (0.41) HTR2CHTR2BHTR2AC1S

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1809545-A N-phenyl-piperazine derivatives and methods of prophylaxis or treatment of 5HT2c ARENA PHARM INC (US) 2006-07-26 CN disclosed
EP-1644347-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT sb 2C /sb RECEPTOR ASSOCIATED DISEASES Arena Pharmaceuticals, Inc. (US) 2006-04-12 EP disclosed
WO-2005016902-A1 N-PHENYL-PIPERAZINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-02-24 WO disclosed