SCHEMBL9335232

SCHEMBL9335232

Fc1ccc2sc(CSc3cccc(CBr)c3)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 1/20 0.38
▸ PTGER4 P35408 1/20 0.38
▸ AKR1B1 P15121 2/20 0.38
▸ AKR1A1 P14550 1/20 0.38
▸ NPC1 O15118 4/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ ALOX5 P09917 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ MGAM O43451 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SI P14410 1/20 0.36
▸ MGAM2 Q2M2H8 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL9335106 0.88 HDAC6 (0.41) HDAC6PTGER4AKR1B1AKR1A1NPC1
SCHEMBL9339010 0.76 PTGER4 (0.56) PTGER4NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL362555 0.76 DYRK1A (0.45) HDAC6PTGER4AKR1B1AKR1A1NPC1
SCHEMBL28984552 0.74 HDAC6 (0.55) HDAC6PTGER4AKR1B1AKR1A1NPC1
SCHEMBL27399288 0.70 NPC1 (0.43) HDAC6PTGER4AKR1B1AKR1A1NPC1
SCHEMBL10721825 0.69 RAB9A (0.53) NPC1RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL6229545 0.69 SMN1; SMN2 (0.56) HDAC6AKR1B1AKR1A1NPC1RAB9A
SCHEMBL7541753 0.69 DYRK1A (0.56) HDAC6AKR1B1AKR1A1NPC1RAB9A
SCHEMBL20651365 0.68 NPC1 (0.46) HDAC6PTGER4AKR1B1AKR1A1NPC1
SCHEMBL9335092 0.68 HSD17B10 (0.43) HDAC6PTGER4AKR1B1AKR1A1NPC1

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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