Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6469939

COc1cc(OC)c2nc(Nc3nc(O)c4cc(OCCN5CCOCC5)ccc4n3)nc(C)c2c1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AVPR1B P47901 7/20 0.43
RAF1 P04049 3/20 0.43
AURKB Q96GD4 1/20 0.40
SIK2 Q9H0K1 1/20 0.40
SIK3 Q9Y2K2 1/20 0.40
PIK3CA P42336 1/20 0.40
HSD17B10 Q99714 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
Trifluoroacetic Acid SCHEMBL6470902 0.93 HRH3 (0.42) AVPR1B
SCHEMBL6469947 0.89 AVPR1B (0.41) AVPR1BRAF1AURKBSIK2SIK3
Trifluoroacetic Acid SCHEMBL6469223 0.88 HRH3 (0.38) AVPR1BAURKBHSD17B10
Trifluoroacetic Acid SCHEMBL6467993 0.88 RAF1 (0.47) AVPR1BRAF1SIK2SIK3
Trifluoroacetic Acid SCHEMBL6467382 0.87 ALDH1A1 (0.38) HSD17B10
Trifluoroacetic Acid SCHEMBL6470080 0.86 KDM4E (0.39) HSD17B10
Trifluoroacetic Acid SCHEMBL6469071 0.85 F2 (0.37) AURKBHSD17B10
Trifluoroacetic Acid SCHEMBL6470895 0.84 MEN1 (0.37)
Trifluoroacetic Acid SCHEMBL6469150 0.83 RET (0.42) AVPR1BRAF1
Trifluoroacetic Acid SCHEMBL6471240 0.83 RET (0.43) AVPR1BRAF1

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 4 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
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 WO claimed
US-20050124562-A1 Bis-quinazoline compounds for the treatment of bacterial infections REPLIDYNE, INC. 2005-06-09 US disclosed
WO-2005030131-A2 BIS-QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS REPLIDYNE, INC (US) 2005-04-07 WO 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 AVPR1B 3769/4885RAF1 2421/4885AURKB 571/4885

“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.