Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6469094

COc1cc2nc(Nc3nc(O)c4cc(OCCn5cccc5)ccc4n3)nc(C)c2cc1OC.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WHR1 P49842 2/20 0.37
AURKA O14965 1/20 0.37
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 5/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
PSMD14 O00487 1/20 0.36
APAF1 O14727 1/20 0.36
MITF O75030 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
PTK2B Q14289 1/20 0.36
EHMT2 Q96KQ7 1/20 0.36
TDP2 O95551 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 1/20 0.35

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
Trifluoroacetic Acid SCHEMBL6469205 0.92 KDM4E (0.36) WHR1AURKAALDH1A1KDM4EMAPT
Trifluoroacetic Acid SCHEMBL6469150 0.89 RET (0.42) WHR1EHMT2
Trifluoroacetic Acid SCHEMBL6466263 0.88 MAPT (0.40) WHR1AURKAALDH1A1KDM4EMAPT
Trifluoroacetic Acid SCHEMBL6467465 0.88 MAPT (0.39) WHR1AURKAALDH1A1KDM4EMAPT
Trifluoroacetic Acid SCHEMBL6469209 0.88 RET (0.43) KDM4EEHMT2PDGFRB
Trifluoroacetic Acid SCHEMBL6471240 0.88 RET (0.43) WHR1AURKAALDH1A1KDM4EEHMT2
Trifluoroacetic Acid SCHEMBL6470209 0.88 MAPT (0.39) WHR1AURKAALDH1A1KDM4EMAPT
Trifluoroacetic Acid SCHEMBL6465517 0.88 KDM4E (0.40) WHR1AURKAALDH1A1KDM4EMAPT
Trifluoroacetic Acid SCHEMBL6470128 0.88 PDK1 (0.41) WHR1AURKAALDH1A1KDM4EMAPT
SCHEMBL6469099 0.88 AURKA (0.36) WHR1AURKAALDH1A1KDM4EMAPT

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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US claimed
US-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 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-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections POLI, POLK, POLB WHR1 4034/4885AURKA 1070/4885ALDH1A1 3154/4885

“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.