Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7375646

COc1ccc2ccc(S(=O)(=O)N[C@@]3(Cc4cc5cnccc5cc4OC)CCNC3=O)cc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAPGEF3 O95398 1/20 0.35
KDM4C Q9H3R0 1/20 0.34
NAMPT P43490 1/20 0.34
HPGDS O60760 1/20 0.34
GPR6 P46095 2/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
F10 P00742 3/20 0.32
PLAU P00749 1/20 0.32
PDE9A O76083 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
F2 P00734 1/20 0.32
PRSS1 P07477 1/20 0.32
MMP2 P08253 1/20 0.32
MMP13 P45452 1/20 0.32

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 SCHEMBL7384671 0.81 NOS1 (0.37) RAPGEF3HPGDSSMN1; SMN2F10F2
Trifluoroacetic Acid SCHEMBL7384596 0.80 ROCK2 (0.36) RAPGEF3NAMPTHPGDSSMN1; SMN2F10
Trifluoroacetic Acid SCHEMBL7385566 0.79 RAPGEF3 (0.35) RAPGEF3HPGDSF10MEN1KMT2A
Trifluoroacetic Acid SCHEMBL7374889 0.79 NOS1 (0.46) RAPGEF3HPGDSF10F2PRSS1
Trifluoroacetic Acid SCHEMBL7471306 0.76 F2 (0.41) RAPGEF3HPGDSF10MEN1KMT2A
Trifluoroacetic Acid SCHEMBL7371957 0.75 F10 (0.58) F10F2PRSS1
SCHEMBL7384370 0.74 MEN1 (0.36) RAPGEF3NAMPTHPGDSCYP3A4F10
SCHEMBL7384883 0.72 F10 (0.40) RAPGEF3F10PLAUMEN1KMT2A
Trifluoroacetic Acid SCHEMBL7370015 0.71 MMP2 (0.35) NAMPTHPGDSGPR6F10PDE9A
SCHEMBL7385658 0.71 PARG (0.36) RAPGEF3HPGDSF10PLAUMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086099-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2002-01-02 EP claimed
EP-1086099-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-03-28 EP claimed
WO-1999062904-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-12-09 WO claimed
EP-1086099-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2002-01-02 EP disclosed
EP-1086099-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-03-28 EP disclosed
WO-1999062904-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-12-09 WO disclosed