SCHEMBL28036621

SCHEMBL28036621

FC(F)(F)C(F)(F)c1ncc[nH]1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.40
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TAAR1 Q96RJ0 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MTOR P42345 1/20 0.31
ADK P55263 1/20 0.31
NISCH Q9Y2I1 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
SCHEMBL9316043 0.83 CYP19A1 (0.36) CYP19A1ALDH1A1SMN1; SMN2TAAR1NPC1
SCHEMBL394747 0.80
SCHEMBL4956403 0.79 CYP19A1 (0.36) CYP19A1ALDH1A1SMN1; SMN2TAAR1
SCHEMBL25335684 0.78 CYP19A1 (0.41) CYP19A1ALDH1A1SMN1; SMN2TAAR1NPC1
Lithium SCHEMBL29579035 0.78 CYP19A1 (0.41) CYP19A1ALDH1A1SMN1; SMN2TAAR1NPC1
SCHEMBL27893639 0.76 CYP19A1 (0.40) CYP19A1ALDH1A1SMN1; SMN2TAAR1NPC1
SCHEMBL4956409 0.73 CYP19A1 (0.38) CYP19A1ALDH1A1SMN1; SMN2TAAR1
SCHEMBL27726056 0.73 CYP19A1 (0.38) CYP19A1ALDH1A1SMN1; SMN2TAAR1
SCHEMBL14438878 0.73 CYP19A1 (0.35) CYP19A1ALDH1A1SMN1; SMN2TAAR1NPC1
SCHEMBL27536537 0.72

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-20250309355-A1 NONAQUEOUS ELECTROLYTE SOLUTION, LITHIUM-ION BATTERY, AND ELECTRONIC DEVICE NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2025-10-02 US disclosed
CN-102948001-B Electrolyte material, electrolyte for lithium secondary battery, lithium secondary battery using same, and novel lithium salt THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO.,LTD. (JP) 2015-09-23 CN disclosed