Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7379290

NCC(=O)NOCc1ccccc1.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.53
RAB9A P51151 6/20 0.53
LTA4H P09960 1/20 0.49
HDAC3 O15379 1/20 0.46
NCOR2 Q9Y618 1/20 0.46
EGFR P00533 1/20 0.44
MMP2 P08253 1/20 0.44
CTSC P53634 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
RECQL P46063 1/20 0.42
CES1 P23141 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
SCHEMBL7970712 0.90 NPC1 (0.62) NPC1RAB9ALTA4HHDAC3NCOR2
Hydrochloric Acid SCHEMBL7442086 0.89 NPC1 (0.61) NPC1RAB9ALTA4HHDAC3NCOR2
Trifluoroacetic Acid SCHEMBL7267200 0.84 NPC1 (0.49) NPC1RAB9AHDAC3NCOR2EGFR
SCHEMBL8691537 0.80 NPC1 (0.59) NPC1RAB9AHDAC3CES1
SCHEMBL7981993 0.80 HDAC3 (0.64) NPC1RAB9ALTA4HHDAC3NCOR2
Trifluoroacetic Acid SCHEMBL7758264 0.80 MEN1 (0.49) RAB9ALTA4HMMP2CYP1A2CYP3A4
Trifluoroacetic Acid SCHEMBL8849659 0.79 ALPI (0.51) NPC1RAB9ALTA4HCTSC
Trifluoroacetic Acid SCHEMBL7760501 0.79 SMN1; SMN2 (0.52) LTA4HMMP2CTSCCES1
Trifluoroacetic Acid SCHEMBL22830136 0.78 ALDH1A1 (0.56) CYP1A2CES1
Trifluoroacetic Acid SCHEMBL7760563 0.78 AOC3 (0.60) RAB9AHDAC3MMP2CYP1A2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3676263-B1 3-HYDROXY-IMIDAZOLIDIN-4-ONE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RES CENTER B V (NL) 2021-10-06 EP disclosed
US-11053230-B2 3-hydroxy-imidazolidin-4-one compounds as inhibitors of indoleamine 2,3-dioxygenase NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. 2021-07-06 US disclosed
US-20200181128-A1 3-HYDROXY-IMIDAZOLIDIN-4-ONE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2020-06-11 US disclosed
EP-3426638-B1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RES CENTER B V (NL) 2020-05-06 EP disclosed
US-20190055213-A1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2019-02-21 US disclosed
EP-3426638-A1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE Netherlands Translational Research Center B.V. (NL) 2019-01-16 EP disclosed
CN-109071457-A Inhibitors of indoleamine 2, 3-dioxygenase 荷兰转化研究中心有限责任公司 2018-12-21 CN disclosed
WO-2017153459-A1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE NETHERLANDS TRANSLATIONAL RESEARCH CENTER B.V. (NL) 2017-09-14 WO disclosed
US-5095137-A Hypotensives LABORATORI GUIDOTTI SPA (IT) 1992-03-10 US disclosed
EP-0337348-A2 Amides of cyclomethylen-1,2-bicarboxylic acids having therapeutical activity, processes for their preparation and pharmaceutical compositions containing them Laboratori Guidotti S.p.A. (IT) 1989-10-18 EP disclosed
US-4028401-A (Substituted)ureidoacetohydroxamic acids MORTON-NORWICH PRODUCTS, INC. (US) 1977-06-07 US 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-20190055213-A1 INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, TPH2 NPC1 1264/4885RAB9A 3505/4885LTA4H 1210/4885
US-11053230-B2 3-hydroxy-imidazolidin-4-one compounds as inhibitors of indoleamine 2,3-dioxygenase IDO1, IDO2, TPH1 NPC1 1419/4885RAB9A 3789/4885LTA4H 1291/4885
US-20200181128-A1 3-HYDROXY-IMIDAZOLIDIN-4-ONE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2,3-DIOXYGENASE IDO1, IDO2, TPH1 NPC1 1419/4885RAB9A 3789/4885LTA4H 1291/4885

“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.