SCHEMBL9531311

SCHEMBL9531311

CC(C)(C)[Si](C)(C)OCc1cccc(C2CC2c2nc3cc(F)ccc3s2)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ P2RY2 P41231 1/20 0.35
▸ CYSLTR1 Q9Y271 7/20 0.33
▸ CYSLTR2 Q9NS75 6/20 0.33
▸ PTGER4 P35408 1/20 0.31
▸ HCRTR1 O43613 1/20 0.31
▸ BACE1 P56817 3/20 0.31
▸ AHR P35869 1/20 0.31
▸ PDE10A Q9Y233 1/20 0.31
▸ DYRK1A Q13627 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
SCHEMBL9335151 0.81 CHRNB4 (0.42) PTGS1PTGS2P2RY2CYSLTR1HCRTR1
SCHEMBL9339059 0.74 KAT8 (0.46) PTGS1PTGS2CYSLTR1CYSLTR2PTGER4
SCHEMBL9531314 0.74 AHR (0.33) P2RY2HCRTR1BACE1AHRPDE10A
SCHEMBL9339062 0.73 CYSLTR1 (0.38) PTGS1PTGS2CYSLTR1CYSLTR2PTGER4
SCHEMBL9527837 0.66 DYRK1A (0.38) P2RY2HCRTR1AHRPDE10ADYRK1A
SCHEMBL1121430 0.62 IDO1 (0.50) —
SCHEMBL11942311 0.61 IDO1 (0.38) —
SCHEMBL840465 0.61 GABRA1 (0.45) BACE1
SCHEMBL4104243 0.61 CCR5 (0.57) —
SCHEMBL9339029 0.61 PTGER4 (0.55) PTGS1PTGS2CYSLTR1CYSLTR2PTGER4

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
EP-0533695-A1 IMIDAZO (4,5-c) PYRIDINES WITH PAF ANTAGONIST ACTIVITY. PFIZER (US) 1993-03-31 — — EP disclosed
WO-1991017163-A1 IMIDAZO (4,5-c) PYRIDINES WITH PAF ANTAGONIST ACTIVITY PFIZER INC. (US) 1991-11-14 — — WO disclosed
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