Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21523769

Fc1cccc(C2CCNCC2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.56
SLC18A3 Q16572 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
QDPR P09417 1/20 0.43
HTR6 P50406 2/20 0.42
NPC1 O15118 1/20 0.42
SCD5 Q86SK9 1/20 0.42
HTR1A P08908 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 2/20 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
SCHEMBL378006 0.86 HTR2C (0.62) HTR2CSLC18A3SIGMAR1QDPRHTR6
Trifluoroacetic Acid SCHEMBL8528751 0.85 SLC18A3 (0.69) HTR2CSLC18A3SIGMAR1HTR6
Hydrochloric Acid SCHEMBL1765281 0.85 HTR2C (0.64) HTR2CSLC18A3SIGMAR1QDPRHTR6
Trifluoroacetic Acid SCHEMBL1870349 0.80 HTR2C (0.50) HTR2CSLC18A3SIGMAR1
Trifluoroacetic Acid SCHEMBL5671633 0.78 OPRL1 (0.49) HTR1ASLC6A2SLC6A4SLC6A3
Trifluoroacetic Acid SCHEMBL29921143 0.77 PDE4A (0.43)
SCHEMBL3648147 0.77 DRD2 (0.51) HTR2CSLC18A3SIGMAR1HTR1ASLC6A2
SCHEMBL31159074 0.77 DRD2 (0.51) HTR2CSLC18A3SIGMAR1HTR1ASLC6A2
SCHEMBL13975332 0.77 DRD2 (0.51) HTR2CSLC18A3SIGMAR1HTR1ASLC6A2
SCHEMBL31158728 0.77 DRD2 (0.51) HTR2CSLC18A3SIGMAR1HTR1ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112566636-A Compound and use thereof 优曼尼蒂治疗公司 2021-03-26 CN disclosed
EP-3784234-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2021-03-03 EP disclosed
US-10919885-B2 Compounds and uses thereof YUMANITY THERAPEUTICS, INC. (US) 2021-02-16 US disclosed
US-20190330198-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2019-10-31 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 (2 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-10919885-B2 Compounds and uses thereof NLN, ACHE, CLN6 HTR2C 1250/4885SLC18A3 54/4885SIGMAR1 1839/4885
US-20190330198-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 HTR2C 1250/4885SLC18A3 54/4885SIGMAR1 1839/4885

“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.