SCHEMBL6640264

SCHEMBL6640264

CCOC(=O)c1cc(C)nc2c(O)cccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR6 P51684 1/20 0.71
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA7 P43166 3/20 0.51
CA9 Q16790 3/20 0.51
CA14 Q9ULX7 3/20 0.51
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
CDC25B P30305 3/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 2/20 0.48
POLB P06746 2/20 0.48
RECQL P46063 2/20 0.48
USP2 O75604 1/20 0.48
KDM4E B2RXH2 3/20 0.48
CYP1A2 P05177 1/20 0.46
TSHR P16473 1/20 0.46
MAPT P10636 2/20 0.45

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
SCHEMBL6590967 0.86 CCR6 (0.54) CCR6CDC25BMEN1KMT2AALDH1A1
SCHEMBL6586612 0.85 CCR6 (0.53) CCR6CDC25BMEN1KMT2AALDH1A1
SCHEMBL31133520 0.78 KDM4E (0.72) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL5810312 0.78 KDM4E (0.72) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL6645842 0.78 CCR6 (0.52) CCR6MAOBMEN1KMT2AKDM4E
SCHEMBL660649 0.76 KDM4E (0.57) CCR6ALDH1A1USP2KDM4EMAPT
SCHEMBL27486150 0.76 CCR6 (0.47) CCR6CA12CA1CA2CA7
SCHEMBL2877622 0.76 KDM4E (0.47) CCR6MEN1KMT2AKDM4ECYP1A2
SCHEMBL30587191 0.76 KDM4E (0.47) CCR6MEN1KMT2AKDM4ECYP1A2
SCHEMBL18106149 0.76 MAOA (0.58) CCR6CA12CA1CA2CA7

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 5 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
CN-1168667-A Pyridopyrimidones, quinolines and fused N-heretocycles as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1997-12-24 CN disclosed
EP-0807105-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-11-19 EP disclosed
WO-1996013485-A1 PYRIDOPYRIMIDONES, QUINOLINES AND FUSED N-HERETOCYCLES AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-09 WO disclosed