SCHEMBL13994424

SCHEMBL13994424

Cc1ccc(F)cc1BC[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ NISCH Q9Y2I1 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ ABL1 P00519 1/20 0.32
▸ FFAR1 O14842 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ MAPK14 Q16539 1/20 0.30
▸ SLC6A2 P23975 5/20 0.30
▸ SLC6A4 P31645 5/20 0.30
▸ SLC6A3 Q01959 5/20 0.30
▸ SLC9A1 P19634 1/20 0.30

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
SCHEMBL13994400 0.79 PTGS1 (0.32) PTGS1PTGS2NISCHALDH1A1ABL1
SCHEMBL13994428 0.74 PTGS1 (0.33) PTGS1PTGS2ALDH1A1FFAR1FFAR4
SCHEMBL13994429 0.73 CYP3A4 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL13994491 0.73 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL13994430 0.73 PYCR1 (0.32) —
SCHEMBL13994405 0.71 ALDH1A1 (0.40) ALDH1A1FFAR1FFAR4
SCHEMBL13994426 0.71 ACHE (0.40) PTGS1PTGS2ALDH1A1FFAR1FFAR4
SCHEMBL2688432 0.71 ACHE (0.36) PTGS1PTGS2NISCHALDH1A1ABL1
SCHEMBL13994470 0.70 GHSR (0.35) PTGS1PTGS2
SCHEMBL13994410 0.70 GHSR (0.35) PTGS1PTGS2

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-7470015-B2 Inkjet-recording ink composition and image-forming process FUJIFILM CORPORATION (JP) 2008-12-30 — — US disclosed
US-7229737-B2 Photopolymerizable composition and recording material and recording process using the same FUJIFILM CORPORATION (JP) 2007-06-12 — — US disclosed
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