SCHEMBL8565485

SCHEMBL8565485

CN(Cc1ccccc1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
TACR1 P25103 1/20 0.45
AOC3 Q16853 1/20 0.45
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
TMEM97 Q5BJF2 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
CHKA P35790 1/20 0.43
MAT2A P31153 1/20 0.43
GAA P10253 1/20 0.42
IP6K1 Q92551 1/20 0.41
DHFR P00374 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CARM1 Q86X55 1/20 0.40
PRMT6 Q96LA8 1/20 0.40

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
SCHEMBL11135166 0.85 TAAR1 (0.54) TSHRALDH1A1SMN1; SMN2AOC3NR1H2
SCHEMBL8263076 0.82 NR1H2 (0.54) TSHRALDH1A1SMN1; SMN2AOC3NR1H2
SCHEMBL24133081 0.80 CYP2C19 (0.52) TSHRALDH1A1SMN1; SMN2NR1H2NR1H3
SCHEMBL642317 0.79 CRHBP (0.61) TSHRALDH1A1AOC3NR1H2NR1H3
SCHEMBL11881187 0.79 NR1H2 (0.62) TSHRALDH1A1AOC3NR1H2NR1H3
SCHEMBL9807149 0.78 CRHBP (0.57) TSHRALDH1A1NR1H2NR1H3CRHBP
SCHEMBL5604665 0.78 TSPO (0.57) TSHRALDH1A1SMN1; SMN2AOC3NR1H2
Hydrochloric Acid SCHEMBL27388371 0.77 CRHBP (0.59) TSHRALDH1A1SMN1; SMN2AOC3NR1H2
SCHEMBL19212236 0.77 NR1H2 (0.49) TSHRALDH1A1SMN1; SMN2AOC3NR1H2
SCHEMBL28819180 0.77 TSHR (0.48) TSHRALDH1A1SMN1; SMN2AOC3NR1H2

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