Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4168050

O=C(NC1CC1)c1n[nH]c2c1CNCC2.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
RBP4 P02753 5/20 0.43
CDK4 P11802 1/20 0.39
CDK2 P24941 1/20 0.39
CDK5 Q00535 1/20 0.39
GAA P10253 1/20 0.37
CRHR1 P34998 1/20 0.35
HCAR2 Q8TDS4 2/20 0.35
KMT2A Q03164 1/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL22482202 0.79 NPC1 (0.45) NPC1RAB9ARBP4CDK5GAA
SCHEMBL22482253 0.78 GSK3B (0.41) NPC1RAB9ARBP4CDK5GAA
SCHEMBL4762236 0.74 GAA (0.41) NPC1RAB9ARBP4GAAHCAR2
SCHEMBL5263474 0.74 HCAR2 (0.61) RBP4HCAR2KMT2A
Trifluoroacetic Acid SCHEMBL29915603 0.73 RBP4 (0.38) RBP4HCAR2KMT2A
Hydrochloric Acid SCHEMBL22615346 0.72 HCAR2 (0.59) RBP4HCAR2KMT2A
SCHEMBL30226131 0.71 NPC1 (0.51) NPC1RAB9ACDK5GAAHCAR2
SCHEMBL4778041 0.71 NPC1 (0.60) NPC1RAB9ACDK2GAACRHR1
SCHEMBL22482116 0.71 RBP4 (0.39) NPC1RAB9ARBP4GAAHCAR2
SCHEMBL4870401 0.70 NPC1 (0.55) NPC1RAB9ARBP4RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099175-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2009-04-16 US disclosed
EP-1991530-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
EP-1991531-A1 CINNOLINE AND QUINOXALINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-19 EP disclosed
EP-1989195-A1 PHOSPHODIESTERASE 10 INHIBITORS Amgen Inc. (US) 2008-11-12 EP disclosed
US-20070287707-A1 Phosphodiesterase 10 inhibitors MEMORY PHARMACEUTICALS CORPORATION 2007-12-13 US disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
WO-2007103260-A1 PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-13 WO disclosed
WO-2007100880-A1 CINNOLINE AND QUINAZOLINE DERIVATES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-09-07 WO disclosed
WO-2007098169-A1 CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2007-08-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099175-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A NPC1 1921/4885RAB9A 533/4885RBP4 3573/4885
US-20070265256-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A NPC1 1992/4885RAB9A 440/4885RBP4 3264/4885
US-20070287707-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A NPC1 2050/4885RAB9A 593/4885RBP4 3368/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.