SCHEMBL9335094

SCHEMBL9335094

C=C(c1cccc(C(C)O)c1)c1ccc2cc(F)ccc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ UGT2B7 P16662 1/20 0.34
▸ TRPV3 Q8NET8 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ CES2 O00748 1/20 0.33
▸ CES1 P23141 1/20 0.33
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ CDK8 P49336 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ BRD2 P25440 1/20 0.32
▸ CREBBP Q92793 1/20 0.32
▸ HSD17B14 Q9BPX1 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 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
SCHEMBL9339015 0.79 CBLB (0.41) UGT2B7TRPV3CDK8BRD4BRD2
SCHEMBL9335203 0.77 UNG (0.40) BACE1NPC1POLBRAB9AKMT2A
SCHEMBL9388341 0.74 MAPT (0.41) NPC1RAB9AKMT2AMAPTHTT
SCHEMBL18463877 0.71 BACE1 (0.50) BACE1NPC1RAB9AKMT2ADRD2
SCHEMBL9335089 0.71 KDM4E (0.60) NPC1RAB9ATRPV3KMT2AMAPT
SCHEMBL9335102 0.71 KDM4E (0.60) NPC1RAB9ATRPV3KMT2AMAPT
SCHEMBL9023447 0.70 HSD17B14 (0.40) BACE1KMT2ADRD3HSD17B14GAA
SCHEMBL10981458 0.69 PTGS1 (0.45) UGT2B7KMT2ABRD4BRD2CREBBP
SCHEMBL9337150 0.69 CYSLTR1 (0.54) KMT2A
SCHEMBL508016 0.67 CES2 (0.52) UGT2B7KMT2ACES2CES1

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
Send feedback