SCHEMBL9335203

SCHEMBL9335203

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UNG P13051 1/20 0.40
▸ BACE1 P56817 1/20 0.37
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NFKB1 P19838 1/20 0.36
▸ NFKB2 Q00653 1/20 0.36
▸ RELA Q04206 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ HSD17B14 Q9BPX1 4/20 0.33
▸ MAOA P21397 2/20 0.33
▸ MAOB P27338 2/20 0.33
▸ CNR2 P34972 2/20 0.33
▸ NPY5R Q15761 1/20 0.33
▸ IDO1 P14902 1/20 0.32
▸ TDO2 P48775 1/20 0.32
▸ MEN1 O00255 2/20 0.32

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
SCHEMBL9335143 0.84 CNR2 (0.48) UNGNPC1RAB9AKDM4EALDH1A1
SCHEMBL9335553 0.79 UNG (0.41) UNGNPC1RAB9AKDM4EALDH1A1
SCHEMBL9335094 0.77 BACE1 (0.36) BACE1NPC1RAB9AKDM4EPOLB
SCHEMBL9335000 0.73 MAPT (0.41) UNGNPC1RAB9AKDM4ESMN1; SMN2
SCHEMBL9023447 0.71 HSD17B14 (0.40) BACE1KDM4EALDH1A1SMN1; SMN2HSD17B14
SCHEMBL9335200 0.71 NPC1 (0.64) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL9335210 0.71 NPC1 (0.64) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL9023714 0.69 IRAK4 (0.47) NPC1RAB9AKDM4EALDH1A1SMN1; SMN2
SCHEMBL18463877 0.69 BACE1 (0.50) BACE1NPC1RAB9AKDM4EALDH1A1
SCHEMBL1745723 0.68 UNG (0.63) UNGALDH1A1MAOAMAOBMEN1

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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