SCHEMBL8566977

SCHEMBL8566977

CN(Cc1ccccc1)c1cc(Cl)c(C=O)c(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.53
ALDH1A1 P00352 5/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSP90AA1 P07900 1/20 0.40
IP6K1 Q92551 1/20 0.39
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
AOC3 Q16853 1/20 0.38
SLC16A3 O15427 1/20 0.38
SLC16A1 P53985 1/20 0.38
MAT2A P31153 1/20 0.38

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
SCHEMBL24132784 0.84 CYP2C19 (0.43) RAB9AALDH1A1LMNANPSR1CRHBP
SCHEMBL24132772 0.81 RAB9A (0.41) RAB9AALDH1A1LMNANPSR1MEN1
SCHEMBL1194125 0.80 TSPO (0.47) RAB9AALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL25926020 0.78 CYP2C19 (0.45) RAB9AALDH1A1LMNANPSR1CRHBP
SCHEMBL8565485 0.76 TSHR (0.48) RAB9AALDH1A1SMN1; SMN2CRHBPCRHR2
SCHEMBL30361533 0.75 RAB9A (0.39) RAB9AALDH1A1LMNANPSR1CRHBP
SCHEMBL24133801 0.75 RAB9A (0.39) RAB9AALDH1A1LMNANPSR1CRHBP
SCHEMBL4049989 0.73 CYP2A6 (0.52) RAB9AALDH1A1KDM4ESMN1; SMN2CRHBP
SCHEMBL18002414 0.73 MAOA (0.46) RAB9AALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL10920233 0.72 ALDH1A1 (0.44) RAB9AALDH1A1KDM4ELMNASMN1; SMN2

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