SCHEMBL9335960

SCHEMBL9335960

C=C(c1cccc(NC[C]=O)c1)c1nc2cc(F)ccc2s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 3/20 0.40
▸ MAPT P10636 5/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ PTGER4 P35408 2/20 0.37
▸ HTT P42858 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ MAOB P27338 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ NAAA Q02083 1/20 0.33
▸ CYSLTR2 Q9NS75 2/20 0.33
▸ CYSLTR1 Q9Y271 2/20 0.33
▸ KAT8 Q9H7Z6 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL9389077 0.79 MAPT (0.48) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9385687 0.78 MAPT (0.46) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9388341 0.78 MAPT (0.41) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9338940 0.78 MAPT (0.42) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9339006 0.77 MAPT (0.44) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9335000 0.77 MAPT (0.41) DYRK1AMAPTNPC1RAB9APTGER4
SCHEMBL9337154 0.75 IRAK4 (0.45) MAPTNPC1RAB9AHTTLMNA
SCHEMBL9336045 0.74 PTGER4 (0.55) NPC1RAB9APTGER4KMT2ASMN1; SMN2
SCHEMBL9335966 0.73 KAT8 (0.51) DYRK1AMAPTNPC1RAB9AHTT
SCHEMBL9337620 0.73 KAT8 (0.51) DYRK1AMAPTNPC1RAB9AHTT

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 2 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
Send feedback