Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL19585232

NCCNC(=O)c1ccc(=O)n(C2CCC(=O)NC2=O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 12/20 0.44
DDB1 Q16531 8/20 0.44
CSNK1A1 P48729 2/20 0.41
IKZF1 Q13422 1/20 0.41
CA2 P00918 2/20 0.38
IKZF3 Q9UKT9 4/20 0.36
IKZF2 Q9UKS7 1/20 0.35
HDAC1 Q13547 3/20 0.35
HDAC2 Q92769 3/20 0.35
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
MAOB P27338 1/20 0.34
TERT O14746 2/20 0.34
MEN1 O00255 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
KMT2A Q03164 1/20 0.34
HDAC3 O15379 1/20 0.34
NCOR2 Q9Y618 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
SCHEMBL19585707 0.85 CRBN (0.49) CRBNDDB1CSNK1A1IKZF1CA2
SCHEMBL19585639 0.77 CRBN (0.51) CRBNDDB1IKZF3CYP1A2TSHR
SCHEMBL23589797 0.76 CRBN (0.41) CRBNDDB1CSNK1A1IKZF1IKZF3
Trifluoroacetic Acid SCHEMBL29922103 0.74 CRBN (0.64) CRBNDDB1CA2IKZF3HDAC1
Trifluoroacetic Acid SCHEMBL17839978 0.74 CRBN (0.64) CRBNDDB1CA2IKZF3HDAC1
SCHEMBL19586331 0.72 ALOX15 (0.44) CRBNDDB1IKZF3CYP1A2TSHR
SCHEMBL19585379 0.70 CRBN (0.42) CRBNDDB1IKZF3CYP1A2TSHR
Trifluoroacetic Acid SCHEMBL23705500 0.69 CRBN (0.65) CRBNDDB1IKZF3
Trifluoroacetic Acid SCHEMBL17873751 0.67 CRBN (0.66) CRBNDDB1IKZF1CA2IKZF3
Trifluoroacetic Acid SCHEMBL17839625 0.67 CRBN (0.68) CRBNDDB1HDAC1HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017197056-A1 BROMODOMAIN TARGETING DEGRONIMERS FOR TARGET PROTEIN DEGRADATION C4 THERAPEUTICS, INC. (US) 2017-11-16 WO disclosed