Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL20522759

O=C(O)C(F)(F)F.O=C(O)c1ccnc(C(F)(F)F)c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
KDM6B O15054 4/20 0.50
KDM5C P41229 4/20 0.50
KDM4C Q9H3R0 4/20 0.50
KDM2A Q9Y2K7 4/20 0.50
KDM3A Q9Y4C1 4/20 0.50
FTO Q9C0B1 3/20 0.50
ALKBH5 Q6P6C2 2/20 0.50
KDM4A O75164 2/20 0.50
TET3 O43151 1/20 0.50
BBOX1 O75936 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
KDM5A P29375 1/20 0.50
ASPH Q12797 1/20 0.50
KDM4D Q6B0I6 1/20 0.50
TET2 Q6N021 1/20 0.50
KDM7A Q6ZMT4 1/20 0.50
KDM8 Q8N371 1/20 0.50
TET1 Q8NFU7 1/20 0.50

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
SCHEMBL29427285 0.95 KDM5C (0.55) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL503171 0.95 KDM5C (0.55) KDM4EKDM6BKDM5CKDM4CKDM2A
Alcohol SCHEMBL28244007 0.87 KDM4C (0.47) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL16094544 0.82 KDM4C (0.53) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL28019417 0.82 VNN1 (0.58) VNN1SMARCA2SMARCA4LOXL2HDAC4
SCHEMBL16036217 0.81 KDM4C (0.52) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL30893039 0.81 KDM4C (0.52) KDM4EKDM6BKDM5CKDM4CKDM2A
SCHEMBL25221330 0.79 VNN1 (0.46) VNN1SMARCA2SMARCA4LOXL2HDAC4
SCHEMBL30016958 0.79 SMARCA2 (0.49) SYKVNN1SMARCA2SMARCA4LOXL2
SCHEMBL16690807 0.79 SMARCA2 (0.49) SYKVNN1SMARCA2SMARCA4LOXL2

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-3601250-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 (ASK 1) INHIBITOR COMPOUNDS Pharmakea, Inc. (US) 2020-02-05 EP disclosed
WO-2018183122-A1 APOPTOSIS SIGNAL-REGULATING KINASE 1 (ASK 1) INHIBITOR COMPOUNDS SIDECAR THERAPEUTICS, INC. (US) 2018-10-04 WO disclosed