SCHEMBL9043136

SCHEMBL9043136

Cc1ccc(-n2c(Br)ccc2C#N)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
KMT2A Q03164 1/20 0.34
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CCR8 P51685 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TGFBR1 P36897 1/20 0.33
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 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
SCHEMBL9041830 0.75 LMNA (0.41) ALDH1A1KDM4EL3MBTL1KMT2ANPC1
SCHEMBL9043421 0.73 KDM4E (0.36) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL9044965 0.72 KMT2A (0.36) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL9044588 0.70 LMNA (0.45) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL9043916 0.70 POLB (0.35) ALDH1A1NPSR1
SCHEMBL14022008 0.68 KDM4E (0.58) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL9043499 0.68 AR (0.36) ALDH1A1KDM4EKMT2A
SCHEMBL24135523 0.62 NOTUM (0.38) ALDH1A1KDM4EL3MBTL1GRIN2DGRIN3B
SCHEMBL30404350 0.62
SCHEMBL81947 0.62

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-0480204-B1 Imidazole derivatives, potent and selective antagonists of angiotensin II receptor FUJISAWA PHARMACEUTICAL CO (JP) 1996-03-20 EP disclosed
US-5215994-A Treating or preventing hypertension or heart failure FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-06-01 US disclosed
US-5210092-A Hypotensive agents FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-05-11 US disclosed
EP-0480204-A1 Imidazole derivatives, potent and selective antagonists of angiotensin II receptor FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP disclosed