SCHEMBL8563797

SCHEMBL8563797

CN(C(=O)c1ccccc1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.53
KMT2A Q03164 1/20 0.53
ACLY P53396 1/20 0.50
NR1H3 Q13133 2/20 0.49
NR1H2 P55055 1/20 0.49
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
HTT P42858 2/20 0.49
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.46
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 1/20 0.46
MDM2 Q00987 1/20 0.46
GPR55 Q9Y2T6 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAOA P21397 2/20 0.44

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
SCHEMBL23558023 0.86 ATM (0.58) KDM4EKMT2AACLYNR1H3EGFR
SCHEMBL14183990 0.84 KMT2A (0.59) KDM4EKMT2ANR1H3NR1H2EGFR
SCHEMBL18585572 0.83 ATF1 (0.42) KDM4EKMT2AACLYEGFRERBB2
SCHEMBL6805255 0.82 PBRM1 (0.44) ACLYHTTPOLBALDH1A1SMN1; SMN2
SCHEMBL493114 0.81 KMT2A (0.75) KDM4EKMT2ANR1H3NR1H2EGFR
SCHEMBL9001651 0.81 KMT2A (0.69) KDM4EKMT2ANR1H3NR1H2EGFR
SCHEMBL12311615 0.80 KMT2A (0.64) KDM4EKMT2ANR1H3NR1H2EGFR
SCHEMBL9001629 0.79 KMT2A (0.62) KDM4EKMT2ANR1H3NR1H2EGFR
SCHEMBL19933594 0.79 ABL1 (0.49) KDM4EKMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL18585849 0.78 ATM (0.54) ATMALDH1A1SMN1; SMN2MAPTMAOA

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-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed