SCHEMBL13994400

SCHEMBL13994400

CCBc1cc(F)ccc1C

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ ACHE P22303 2/20 0.32
▸ NISCH Q9Y2I1 1/20 0.32
▸ CHRM3 P20309 1/20 0.31
▸ ABL1 P00519 2/20 0.31
▸ MEP1B Q16820 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ KCNH2 Q12809 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
SCHEMBL13994491 0.81 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL13994424 0.79 PTGS1 (0.33) PTGS1PTGS2NISCHABL1ALDH1A1
SCHEMBL13994428 0.79 PTGS1 (0.33) PTGS1PTGS2MEP1BMAPK1ALDH1A1
SCHEMBL13994470 0.78 GHSR (0.35) PTGS1PTGS2ACHE
SCHEMBL13994410 0.78 GHSR (0.35) PTGS1PTGS2ACHE
SCHEMBL13994429 0.77 CYP3A4 (0.30) HTR2ASLC6A4
SCHEMBL13994430 0.77 PYCR1 (0.32) —
SCHEMBL13994408 0.77 RAB9A (0.32) MAPK1ALDH1A1SLC6A4
SCHEMBL13994405 0.76 ALDH1A1 (0.40) TSHRMAPK1ALDH1A1
SCHEMBL13994426 0.76 ACHE (0.40) PTGS1PTGS2ACHEALDH1A1

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
Send feedback