SCHEMBL9335106

SCHEMBL9335106

OCc1cccc(SCc2nc3cc(F)ccc3s2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 2/20 0.41
▸ AKR1B1 P15121 2/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PTGER4 P35408 1/20 0.40
▸ AKR1A1 P14550 1/20 0.40
▸ TRPV1 Q8NER1 2/20 0.39
▸ ALOX5 P09917 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ DYRK1A Q13627 1/20 0.36
▸ CYSLTR1 Q9Y271 4/20 0.36
▸ CYSLTR2 Q9NS75 3/20 0.36

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
SCHEMBL9335232 0.88 HDAC6 (0.38) HDAC6AKR1B1PTGER4AKR1A1ALOX5
SCHEMBL9335092 0.80 HSD17B10 (0.43) HDAC6AKR1B1HSD17B10PTGER4AKR1A1
SCHEMBL9339227 0.76 PTGER4 (0.58) PTGER4ALOX5NPC1RAB9AMAPT
SCHEMBL9335004 0.74 HSD17B10 (0.39) HDAC6AKR1B1HSD17B10PTGER4AKR1A1
SCHEMBL9339297 0.74 NPC1 (0.50) HDAC6AKR1B1HSD17B10PTGER4AKR1A1
SCHEMBL28984552 0.74 HDAC6 (0.55) HDAC6AKR1B1PTGER4AKR1A1NPC1
SCHEMBL9335490 0.73 RAB9A (0.50) HSD17B10TRPV1NPC1RAB9AMAPT
SCHEMBL9338940 0.72 MAPT (0.42) HDAC6HSD17B10PTGER4TRPV1NPC1
SCHEMBL7541753 0.71 DYRK1A (0.56) HDAC6AKR1B1AKR1A1TRPV1ALOX5
SCHEMBL9338937 0.70 KAT8 (0.50) HSD17B10ALOX5EPHX2NPC1RAB9A

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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