Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1101495

COc1ccc(Cn2c(C(=O)Nc3ccc(N4CCC4)nc3)cc3cccnc32)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.42
RAB9A P51151 1/20 0.41
LMNA P02545 2/20 0.41
CACNA1H O95180 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DGAT1 O75907 5/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TP53 P04637 3/20 0.40
HTT P42858 1/20 0.40
THRB P10828 1/20 0.40
MAPT P10636 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CSF1R P07333 1/20 0.40
DAPK1 P53355 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL1100061 0.95 FASN (0.45) FASNRAB9ALMNACACNA1HL3MBTL1
Trifluoroacetic Acid SCHEMBL1100995 0.93 DGAT1 (0.44) LMNADGAT1HTTMAPT
Trifluoroacetic Acid SCHEMBL1101032 0.92 DGAT1 (0.45) DGAT1ALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL1101066 0.90 FASN (0.42) FASNLMNACACNA1HDGAT1TP53
Trifluoroacetic Acid SCHEMBL1100255 0.89 KDM4E (0.43) FASNLMNACACNA1HDGAT1ALDH1A1
SCHEMBL1099159 0.87 DGAT1 (0.47) FASNLMNADGAT1ALDH1A1TSHR
SCHEMBL1100494 0.86 CNR1 (0.49) RAB9ACACNA1HDGAT1ALDH1A1
SCHEMBL1100786 0.86 CNR1 (0.47) RAB9AL3MBTL1DGAT1
SCHEMBL1100783 0.86 L3MBTL1 (0.47) FASNRAB9ACACNA1HL3MBTL1DGAT1
Trifluoroacetic Acid SCHEMBL1099895 0.86 MAPT (0.44) LMNAL3MBTL1DGAT1ALDH1A1MAPT

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
US-8716272-B2 N-(amino-heteroaryI)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI (FR) 2014-05-06 US disclosed
US-8716273-B2 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI (FR) 2014-05-06 US disclosed
US-20120142669-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI-AVENTIS (FR) 2012-06-07 US disclosed
US-20120142670-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI-AVENTIS (FR) 2012-06-07 US disclosed
US-8153650-B2 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI-AVENTIS (FR) 2012-04-10 US disclosed
US-20100041634-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy SANOFI-AVENTIS (FR) 2010-02-18 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-20120142670-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy ZYX, NQO2, PYCR1 FASN 1957/4885RAB9A 2711/4885LMNA 2507/4885
US-20120142669-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy ZYX, NQO2, PYCR1 FASN 1957/4885RAB9A 2711/4885LMNA 2507/4885
US-20100041634-A1 N-(amino-heteroaryl)-1H-pyrrolopyridine-2-carboxamides derivatives preparation thereof and their use in therapy ZYX, NQO2, PYCR1 FASN 1957/4885RAB9A 2711/4885LMNA 2507/4885

“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.