Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5120141

O=C(NCc1ccc(Cl)cc1)C1=NOC2(CCNCC2)C1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
THRB P10828 2/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
GAA P10253 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
EPHX2 P34913 1/20 0.38
LMNA P02545 5/20 0.38
TSHR P16473 1/20 0.38
TACR1 P25103 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL5115334 0.93 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1HPGDTHRBMAPT
Hydrochloric Acid SCHEMBL5116601 0.92 HPGD (0.44) SMN1; SMN2ALDH1A1HPGDTHRBMAPT
SCHEMBL12825219 0.85 TACR1 (0.43) SMN1; SMN2EPHX2TACR1
Ammonia Solution, Strong SCHEMBL5113991 0.85 TACR1 (0.43) SMN1; SMN2EPHX2TACR1
Hydrochloric Acid SCHEMBL5120599 0.85 TACR1 (0.43) SMN1; SMN2EPHX2TACR1
SCHEMBL2404585 0.84 ATM (0.45) SMN1; SMN2ALDH1A1HPGDGAAKMT2A
Trifluoroacetic Acid SCHEMBL1457747 0.83 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1HPGDTHRBMAPT
Hydrochloric Acid SCHEMBL2401223 0.83 ATM (0.44) SMN1; SMN2ALDH1A1HPGDGAAKMT2A
SCHEMBL12825008 0.81 EPHX2 (0.47) KMT2AMEN1EPHX2LMNACYP1A2
Hydrochloric Acid SCHEMBL5119487 0.81 EPHX2 (0.46) KMT2AMEN1EPHX2LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214807-A1 Substituted Spiro Compounds and their Use for Producing Drugs GRUENENTHAL GMBH (DE) 2008-09-04 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 (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-20080214807-A1 Substituted Spiro Compounds and their Use for Producing Drugs REN, PKD1, NR3C2 SMN1; SMN2 4677/4885ALDH1A1 281/4885HPGD 100/4885

“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.