SCHEMBL9337065

SCHEMBL9337065

C=C(c1cccc(C(=O)OC)c1)c1nc2cc(Cl)ccc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PFKFB3 Q16875 1/20 0.47
▸ PFKFB4 Q16877 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ NPC1 O15118 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ RAB9A P51151 4/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CRHBP P24387 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CRHR2 Q13324 1/20 0.43
▸ PPARA Q07869 6/20 0.42
▸ AGPAT2 O15120 1/20 0.42
▸ DRD2 P14416 1/20 0.41

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
SCHEMBL9389077 0.86 MAPT (0.48) ALDH1A1NPC1MAPTRAB9AMEN1
SCHEMBL9383652 0.78 HSD17B10 (0.42) ALDH1A1NPC1MAPTRAB9AMEN1
SCHEMBL4957637 0.78 MAPT (0.44) L3MBTL1ALDH1A1NPC1MAPTRAB9A
SCHEMBL9337056 0.76 KAT8 (0.48) PFKFB3PFKFB4L3MBTL1CYP1A2CYP3A4
SCHEMBL9337075 0.76 KAT8 (0.48) PFKFB3PFKFB4L3MBTL1CYP1A2CYP3A4
SCHEMBL1121389 0.73 NPC1 (0.50) L3MBTL1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL28258783 0.72 PPARA (0.54) ALDH1A1NPC1MAPTRAB9AMEN1
SCHEMBL24962530 0.72 SMN1; SMN2 (0.57) MAPTMEN1KMT2APPARASMN1; SMN2
SCHEMBL30209129 0.72 SMN1; SMN2 (0.57) MAPTMEN1KMT2APPARASMN1; SMN2
SCHEMBL9385687 0.71 MAPT (0.46) CYP1A2CYP2C9NPC1MAPTRAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0533695-B1 IMIDAZO (4,5-c) PYRIDINES WITH PAF ANTAGONIST ACTIVITY PFIZER (US) 1994-10-05 — — EP disclosed
US-5322847-A Inhibit platelet activating factor, block leukotriene D4 receptors PFIZER INC. (US) 1994-06-21 — — US disclosed
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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