Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4242769

N=C(N)NC(=O)c1cn(-c2cnnc3ccccc23)c2ccccc12.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.34
IDO1 P14902 1/20 0.34
TPSAB1 Q15661 2/20 0.33
NR4A2 P43354 1/20 0.33
AKT1 P31749 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
HTR3A P46098 5/20 0.32
RORC P51449 2/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
C1S P09871 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.31
RAD52 P43351 1/20 0.31

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
SCHEMBL4244748 0.93 HTR3A (0.35) NR4A2AKT1HTR3AHDAC1HDAC2
SCHEMBL4242771 0.85 MALT1 (0.34) MALT1IDO1NR4A2AKT1KDM4E
Trifluoroacetic Acid SCHEMBL4243180 0.84 PIK3R2 (0.41) KDM4ERORCL3MBTL1LMNA
SCHEMBL4060477 0.81 ELANE (0.41) MALT1HTR3A
SCHEMBL4245433 0.80 ADRB2 (0.43) KDM4ERORCLMNA
SCHEMBL4243249 0.80 HSP90AA1 (0.37) KDM4EHTTL3MBTL1
Hydrochloric Acid SCHEMBL4240234 0.80 ADRB2 (0.43) KDM4ERORCLMNA
Trifluoroacetic Acid SCHEMBL4241090 0.78 NTSR1 (0.43) KDM4EHTT
SCHEMBL4247704 0.77 HTR3A (0.38) MALT1NR4A2HTR3A
Trifluoroacetic Acid SCHEMBL4240979 0.77 L3MBTL1 (0.35) MALT1IDO1TPSAB1HTR3ARORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531663-B2 3-guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-05-12 US disclosed
US-20050026989-A1 3-Guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-02-03 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-20050026989-A1 3-Guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them IDO1, IDO2, HTR3C MALT1 2550/4885IDO1 1/4885TPSAB1 516/4885

“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.