Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4421349

O=C(NCC1C2CNCC21)c1ccc(N2CCOCC2)c(F)c1.O=C(O)C(F)(F)F

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
HPGD P15428 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
RAB9A P51151 2/20 0.49
TP53 P04637 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
USP30 Q70CQ3 4/20 0.48
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
F10 P00742 1/20 0.43
HTT P42858 1/20 0.42
MAOB P27338 3/20 0.42
SLC6A9 P48067 1/20 0.42
SLC6A5 Q9Y345 1/20 0.42
MAOA P21397 1/20 0.42
PTGS1 P23219 1/20 0.42
CALML3 P27482 1/20 0.42
SDHA P31040 1/20 0.42

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
SCHEMBL4423697 0.94 NPC1 (0.53) NPC1HPGDSMN1; SMN2RAB9ATP53
Trifluoroacetic Acid SCHEMBL4421351 0.85 NPC1 (0.47) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4419241 0.79 USP30 (0.53) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4419218 0.78 USP30 (0.51) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4413697 0.77 USP30 (0.53) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4415018 0.77 USP30 (0.52) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4552123 0.77 USP30 (0.52) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4425821 0.77 USP30 (0.54) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4421358 0.77 USP30 (0.50) NPC1HPGDSMN1; SMN2RAB9ATP53
SCHEMBL4421228 0.76 USP30 (0.49) NPC1HPGDSMN1; SMN2RAB9ATP53

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-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 EP disclosed
EP-1680124-A4 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2009-05-13 EP disclosed
US-7473787-B2 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC (US) 2009-01-06 US disclosed
EP-1680124-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS Pfizer Products Incorporated (US) 2006-07-19 EP disclosed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US disclosed
WO-2005037216-A2 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PRODUCTS INC. (US) 2005-04-28 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 (1 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-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors SLC6A5, SLC1A5, SLC6A3 NPC1 301/4885HPGD 2537/4885SMN1; SMN2 4003/4885

“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.