SCHEMBL9723675

SCHEMBL9723675

O=C(Nc1ccc(Cl)cc1)/C(Cl)=N/Nc1ccc(Cl)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.76
CA2 P00918 6/20 0.76
CA7 P43166 5/20 0.76
CA4 P22748 4/20 0.76
MAPT P10636 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
GAA P10253 1/20 0.54
RECQL P46063 1/20 0.54
GFER P55789 1/20 0.54
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPK1 P28482 1/20 0.47
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.43
NPY1R P25929 1/20 0.43

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
SCHEMBL9723676 1.00 CA1 (0.76) CA1CA2CA7CA4MAPT
SCHEMBL9723609 0.88 CA1 (0.62) CA1CA2CA7CA4MAPT
SCHEMBL9723601 0.88 CA1 (0.62) CA1CA2CA7CA4MAPT
SCHEMBL2174834 0.81 CA2 (0.54) CA1CA2CA7CA4MAPT
SCHEMBL2174838 0.81 CA2 (0.54) CA1CA2CA7CA4MAPT
SCHEMBL4104755 0.80 CA1 (0.53) CA1CA2CA7CA4MAPT
SCHEMBL9068333 0.80 CA1 (0.52) CA1CA2CA7CA4MAPT
SCHEMBL15047078 0.80 CA1 (0.52) CA1CA2CA7CA4MAPT
SCHEMBL9068078 0.80 CA1 (0.52) CA1CA2CA7CA4MAPT
SCHEMBL9633483 0.79 CA1 (0.51) CA1CA2CA7CA4MAPT

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
US-5091405-A Insecticidal pyrazolines E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-02-25 US disclosed
EP-0330678-B1 INSECTICIDAL PYRAZOLINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-10-24 EP disclosed
EP-0330678-A1 INSECTICIDAL PYRAZOLINES. DU PONT (US) 1989-09-06 EP disclosed
WO-1988006583-A1 INSECTICIDAL PYRAZOLINES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-09-07 WO disclosed