SCHEMBL9368563

SCHEMBL9368563

Nc1nc2cc(-n3nc4c(c3Cl)CCCC4)c(F)cc2s1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.39
KCNH2 Q12809 6/20 0.39
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
AXL P30530 1/20 0.35
GFER P55789 1/20 0.35
ACHE P22303 4/20 0.33
BCHE P06276 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL10568453 0.84 ACHE (0.32) ACHEBCHEGRIN1GRIN2A
SCHEMBL10742487 0.78 ACHE (0.35) ACHEBCHEGRIN1GRIN2A
SCHEMBL9369802 0.74 MAPT (0.41) ACHEBCHEGRIN1GRIN2A
SCHEMBL9368678 0.74 CMA1 (0.35) TP53TSHRSMN1; SMN2LMNA
SCHEMBL7797875 0.72
SCHEMBL9369024 0.72 PPOX (0.34)
SCHEMBL9835068 0.71 ACHE (0.40) TP53ACHEBCHEGRIN1GRIN2A
SCHEMBL7941439 0.71 ACHE (0.38) ALDH1A1TSHRACHEBCHEGRIN1
SCHEMBL9368864 0.71 CNR2 (0.33)
SCHEMBL11081553 0.71 SMN1; SMN2 (0.30) SMN1; 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62238285-A None JP disclosed
EP-0235567-B1 Indazole compounds, their production, use and intermediates SUMITOMO CHEMICAL CO (JP) 1994-01-12 EP disclosed
US-4831150-A HERBICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-05-16 US disclosed
US-4831149-A HERBICIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-05-16 US disclosed
US-4820333-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-04-11 US disclosed
JP-S62238285-A 4,5,6,7-TETRAHYDRO-2H-INDAZOLE DERIVATIVE AND PRODUCTION THEREOF SUMITOMO CHEM CO LTD 1987-10-19 JP disclosed
EP-0235567-A2 Indazole compounds, their production, use and intermediates SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-09-09 EP disclosed