SCHEMBL6642183

SCHEMBL6642183

CCN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(C)c(CO)c1C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
RAD52 P43351 2/20 0.45
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 2/20 0.41
GAA P10253 3/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL6641965 0.90 MAPT (0.42) MAPTRAD52ALDH1A1KDM4EPOLB
SCHEMBL6644195 0.86 MAPT (0.44) MAPTRAD52ALDH1A1POLBGAA
SCHEMBL6644261 0.84 MEN1 (0.39) MAPTRAD52ALDH1A1KDM4EPOLB
SCHEMBL6643025 0.80 KMT2A (0.39) MAPTRAD52ALDH1A1KDM4EPOLB
SCHEMBL8367618 0.76 BDKRB2 (0.43) MAPTRAD52POLBGAA
SCHEMBL6640229 0.75 POLB (0.42) MAPTRAD52ALDH1A1POLBGAA
SCHEMBL6645090 0.74 POLB (0.43) MAPTRAD52ALDH1A1POLBGAA
SCHEMBL6643020 0.73 KMT2A (0.39) MAPTRAD52ALDH1A1KDM4EPOLB
SCHEMBL6644197 0.70 GAA (0.40) MAPTRAD52ALDH1A1POLBGAA
SCHEMBL9158223 0.70 ALDH1A1 (0.55) MAPTALDH1A1KDM4EPOLBMEN1

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-0807105-B1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO (JP) 2004-06-16 EP disclosed
US-5994368-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, ANALGESICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-30 US disclosed
WO-1996013485-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-09 WO disclosed