SCHEMBL9336728

SCHEMBL9336728

C=C(c1cccc(C(=O)OC)c1)c1ccccn1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.55
▸ MAPT P10636 2/20 0.55
▸ POLB P06746 1/20 0.55
▸ PKM P14618 5/20 0.51
▸ RAB9A P51151 8/20 0.49
▸ NPC1 O15118 6/20 0.49
▸ CDK5 Q00535 1/20 0.49
▸ CDK5R1 Q15078 1/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ NFKB2 Q00653 2/20 0.47
▸ RELA Q04206 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HTT P42858 3/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ TSHR P16473 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ GRM4 Q14833 1/20 0.46
▸ KCNK3 O14649 1/20 0.46
▸ KCNK9 Q9NPC2 1/20 0.46

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
SCHEMBL30039573 0.87 MAPT (0.67) KDM4EMAPTPOLBPKMRAB9A
SCHEMBL23535713 0.87 MAPT (0.67) KDM4EMAPTPOLBPKMRAB9A
SCHEMBL9335427 0.80 TSHR (0.62) KDM4EMAPTPOLBRAB9ANPC1
Methyl Alcohol SCHEMBL28469619 0.78 TSHR (0.67) MAPTPOLBRAB9ANPC1SMN1; SMN2
SCHEMBL25236791 0.77 KMT2A (0.56) MAPTPKMRAB9ANPC1SMN1; SMN2
SCHEMBL29390740 0.77 KMT2A (0.56) MAPTPKMRAB9ANPC1SMN1; SMN2
SCHEMBL29576494 0.76 KDM4E (0.68) KDM4EMAPTPOLBPKMRAB9A
SCHEMBL30166417 0.76 KDM4E (0.68) KDM4EMAPTPOLBPKMRAB9A
SCHEMBL247011 0.76 KDM4E (0.68) KDM4EMAPTPOLBPKMRAB9A
SCHEMBL5562975 0.76 GRM5 (0.64) KDM4EHTTALOX15TSHRKDM6B

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 3 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
WO-1991017163-A1 IMIDAZO (4,5-c) PYRIDINES WITH PAF ANTAGONIST ACTIVITY PFIZER INC. (US) 1991-11-14 — — WO disclosed
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