SCHEMBL7941448

SCHEMBL7941448

Cc1c2c(nn1-c1ccc(Cl)cc1F)CCCC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC34A1 Q06495 1/20 0.38
OPRM1 P35372 1/20 0.36
PHGDH O43175 1/20 0.36
ACHE P22303 5/20 0.36
BCHE P06276 4/20 0.36
CHRM1 P11229 1/20 0.36
EPHX2 P34913 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
SOS1 Q07889 2/20 0.36
CACNA2D1 P54289 1/20 0.36
CACNA2D2 Q9NY47 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
PSEN1 P49768 2/20 0.35
PSEN2 P49810 2/20 0.35
APH1B Q8WW43 2/20 0.35
NCSTN Q92542 2/20 0.35

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
SCHEMBL11593370 0.86 ACHE (0.38) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL7941439 0.86 ACHE (0.38) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11594039 0.84 ACHE (0.42) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11664985 0.84 LMNA (0.39) SLC34A1ACHEBCHELMNAGRIN1
SCHEMBL11594212 0.84 ENPP2 (0.36) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11594132 0.83 ACHE (0.38) OPRM1ACHEBCHECHRM1EPHX2
SCHEMBL11623109 0.83 GABRA1 (0.35) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11626042 0.83 ALDH1A1 (0.36) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11642571 0.83 KMT2A (0.38) ACHEBCHECHRM1EPHX2KMT2A
SCHEMBL11625332 0.82 PTGS2 (0.37) ACHEBCHECHRM1EPHX2KMT2A

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
US-6239076-B1 SUCH AS 3-CHLORO-2-(4-CHLORO-5-(3-PHENYL-5-METHYLISOXAZOLIN-5-YL)METHOXY-2 -FLUOROPHENYL)-4,5,6,7-TETRAHYDRO-2H-INDAZOLE; HERBICIDES FOR CONTROLLING RICE PADDY WEEDS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2001-05-29 US disclosed
WO-2000050407-A1 HERBICIDAL 2-(5-ISOXAZOLINYL METHYLOXYPHENYL) -4,5,6,7-TETRAHYDRO -2H-INDAZOLE DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2000-08-31 WO disclosed
US-4835286-A 2-Substituted phenyl-4,5,6,7-tetrahydro-2H-indazoles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-05-30 US disclosed
US-4670043-A Herbicidal 2-substituted phenyl-4,5,6,7-tetrahydro-2H-indazoles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-06-02 US disclosed
US-4624699-A 2-substituted phenyl-4,5,6,7-tetrahydro-2H-indazoles, their production, and use as herbicides SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1986-11-25 US disclosed
EP-0105721-A2 2-Substituted phenyl-4,5,6,7-tetrahydro-2H-indazoles, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-04-18 EP disclosed
US-4124374-A Alkyl-substituted cycloalkanapyrazole herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-11-07 US disclosed