Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1462886

O=C(Nc1ccc(C(F)(F)F)nc1C1CCNCC1)c1ccnc(Cl)c1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.38
CDK4 P11802 1/20 0.37
CDK2 P24941 1/20 0.37
CDK5 Q00535 1/20 0.37
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
CCNT1 O60563 1/20 0.37
CDK9 P50750 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
SCHEMBL1726705 0.96 SLC6A3 (0.42) SLC6A3KCNH2TAAR1IRAK4SMARCA2
Trifluoroacetic Acid SCHEMBL1463150 0.85 SLC6A3 (0.40) SLC6A3KCNH2TAAR1CDK4CDK2
SCHEMBL1725098 0.79 SLC6A3 (0.43) SLC6A3KCNH2TAAR1TAS1R3TAS1R1
SCHEMBL1727518 0.79 SLC6A3 (0.45) SLC6A3KCNH2TAAR1TAS1R3TAS1R1
SCHEMBL1462914 0.78 GPR119 (0.42)
SCHEMBL2681577 0.78 MEN1 (0.44) SLC6A3KCNH2TAAR1CDK2TAS1R3
SCHEMBL1727318 0.76 MCHR1 (0.44)
SCHEMBL433524 0.76 RAF1 (0.43) SLC6A3KCNH2TAAR1
SCHEMBL1420945 0.75 MCHR1 (0.40)
SCHEMBL1420947 0.75 MCHR1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10034476-B2 Insecticidal phenyl-or pyridyl-piperdine compounds SYNGENTA PARTICIPATIONS AG (CH) 2018-07-31 US disclosed
US-20170347650-A1 INSECTICIDAL PHENYL-OR PYRIDYL-PIPERDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-12-07 US disclosed
US-9808006-B2 Insecticidal phenyl-or pyridyl-piperdine compounds SYNGENTA PARTICIPATIONS AG (CH) 2017-11-07 US disclosed
EP-2451801-B1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2014-08-13 EP disclosed
US-20130317062-A1 INSECTICIDAL PHENYL-OR PYRIDYL-PIPERDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2013-11-28 US disclosed
US-8586593-B2 Insecticidal compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-11-19 US disclosed
US-8518971-B2 Insecticidal phenyl- or pyridyl-piperdine compounds SYNGENTA CROP PROTECTION, INC. (US) 2013-08-27 US disclosed
US-8193362-B2 Insecticidal compounds SYNGENTA CROP PROTECTION LLC (US) 2012-06-05 US disclosed
WO-2012037282-A3 CATALYSTS AND METHODS FOR POLYMER SYNTHESIS NOVOMER, INC. (US) 2012-05-10 WO disclosed
US-20120115884-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2012-05-10 US disclosed
EP-2297136-B1 INSECTICIDAL PYRIDYLPIPERIDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-12-28 EP disclosed
EP-2324010-B1 INSECTICIDAL PHENYL- OR PYRIDYL-PIPERIDINE COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2011-11-30 EP disclosed
US-20110136866-A1 INSECTICIDAL PHENYL- OR PYRIDYL-PIPERDINE COMPOUNDS SYNGENTA CROP PROTECTION LLC (US) 2011-06-09 US disclosed
US-20110071191-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-03-24 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 (6 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-10034476-B2 Insecticidal phenyl-or pyridyl-piperdine compounds ACHE, CHRM1, CHRM2 SLC6A3 4236/4885KCNH2 457/4885TAAR1 55/4885
US-20120115884-A1 INSECTICIDAL COMPOUNDS ACHE, C1R, C5 SLC6A3 4609/4885KCNH2 1085/4885TAAR1 344/4885
US-20130317062-A1 INSECTICIDAL PHENYL-OR PYRIDYL-PIPERDINE COMPOUNDS ACHE, CHRM1, CHRM2 SLC6A3 4236/4885KCNH2 457/4885TAAR1 55/4885
US-20110071191-A1 INSECTICIDAL COMPOUNDS CBR3, CBR1, ACHE SLC6A3 2888/4885KCNH2 132/4885TAAR1 114/4885
US-20110136866-A1 INSECTICIDAL PHENYL- OR PYRIDYL-PIPERDINE COMPOUNDS ACHE, CHRM1, CHRM2 SLC6A3 4116/4885KCNH2 442/4885TAAR1 63/4885
US-20170347650-A1 INSECTICIDAL PHENYL-OR PYRIDYL-PIPERDINE COMPOUNDS ACHE, CHRM1, CHRM2 SLC6A3 4236/4885KCNH2 457/4885TAAR1 55/4885

“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.