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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1853964

CN(C)C(=O)C1CCC(N)(C(=O)c2cc3cc(Cl)ccc3[nH]2)C(N)C1.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 6/20 0.41
▸ HRH4 Q9H3N8 2/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ SMYD3 Q9H7B4 1/20 0.41
▸ F7 P08709 1/20 0.40
▸ F3 P13726 1/20 0.40
▸ PYGL P06737 10/20 0.40
▸ F2 P00734 1/20 0.40
▸ PLAT P00750 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
SCHEMBL743889 0.94 HRH4 (0.46) F10HRH4HRH3SMYD3F7
SCHEMBL27547475 0.79 KMT2A (0.58) HRH4HRH3SMYD3PYGL
SCHEMBL27520223 0.79 SMYD3 (0.45) HRH4HRH3SMYD3F7F3
Hydrochloric Acid SCHEMBL742545 0.79 KMT2A (0.57) HRH4HRH3SMYD3PYGL
Trifluoroacetic Acid SCHEMBL4093913 0.78 F10 (0.57) F10SMYD3PYGLF2PLAT
Hydrochloric Acid SCHEMBL741656 0.78 SMYD3 (0.44) HRH4HRH3SMYD3F7F3
SCHEMBL739788 0.75 SMYD3 (0.51) HRH4HRH3SMYD3F7F3
Trifluoroacetic Acid SCHEMBL742753 0.74 SMYD3 (0.45) HRH4HRH3SMYD3F7F3
Hydrochloric Acid SCHEMBL741745 0.74 SMYD3 (0.50) HRH4HRH3SMYD3F7F3
SCHEMBL743134 0.74 FLT3 (0.47) HRH4HRH3SMYD3F7F3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7935824-B2 Ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2011-05-03 — — US disclosed