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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30679285

N=C(N)NCCC[C@H](NC(=O)c1sccc1NS(=O)(=O)c1cccc2nsnc12)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.70

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NRP1 O14786 10/20 0.70
▸ NPR1 P16066 1/20 0.70
▸ CCKAR P32238 10/20 0.47
▸ CCKBR P32239 10/20 0.47

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
SCHEMBL4569813 0.96 NRP1 (0.76) NRP1NPR1CCKARCCKBR
SCHEMBL29066366 0.90 NRP1 (0.60) NRP1NPR1CCKARCCKBR
SCHEMBL4572338 0.88 NRP1 (0.65) NRP1NPR1CCKARCCKBR
SCHEMBL4572299 0.86 NRP1 (0.77) NRP1NPR1CCKARCCKBR
SCHEMBL4569831 0.84 NRP1 (0.77) NRP1NPR1
Trifluoroacetic Acid SCHEMBL29655756 0.84 NRP1 (0.50) NRP1NPR1CCKARCCKBR
SCHEMBL4572336 0.84 NRP1 (0.72) NRP1NPR1CCKARCCKBR
SCHEMBL4569863 0.83 NRP1 (0.58) NRP1NPR1CCKARCCKBR
SCHEMBL4569817 0.82 NRP1 (0.57) NRP1NPR1
SCHEMBL4569824 0.81 NRP1 (0.60) NRP1NPR1

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-20240316011-A1 ANTI-FIBROSIS PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF WEST CHINA SECOND UNIVERSITY HOSPITAL (CN) 2024-09-26 — — US disclosed
EP-4282424-A1 ANTI-FIBROSIS PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF West China Second University Hospital (CN) 2023-11-29 — — EP disclosed