SCHEMBL7995535

SCHEMBL7995535

SCCNCc1ccc(C=C(Cl)Cl)nc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
PDCD1 Q15116 7/20 0.35
CD274 Q9NZQ7 7/20 0.35
OXTR P30559 1/20 0.35
AVPR1A P37288 1/20 0.35
PLK1 P53350 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.32
CXCR4 P61073 1/20 0.32
RRM2 P31350 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NLRP3 Q96P20 1/20 0.31

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
SCHEMBL5833071 0.78 KDM4E (0.53) KDM4EL3MBTL1OXTRAVPR1APLK1
SCHEMBL7993868 0.74 KDM4E (0.47) KDM4EL3MBTL1RRM2
SCHEMBL7995688 0.71 CYP11B1 (0.38) PDCD1CD274CXCR4
SCHEMBL7981951 0.71 CXCR4 (0.38) L3MBTL1PDCD1CD274CXCR4
SCHEMBL7981959 0.71 GAA (0.43) KDM4EPDCD1CD274GAACXCR4
SCHEMBL7992274 0.71 PDCD1 (0.34) KDM4EL3MBTL1PDCD1CD274OXTR
SCHEMBL7992251 0.69 CXCR4 (0.43) L3MBTL1PDCD1CD274CXCR4SMN1; SMN2
SCHEMBL5833308 0.69 KDM4E (0.50) KDM4EL3MBTL1OXTRAVPR1APLK1
SCHEMBL7999142 0.69 CXCR4 (0.40) KDM4EPDCD1CD274CXCR4
SCHEMBL7999393 0.68 CXCR4 (0.33) PDCD1CD274CXCR4

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6297374-B1 Nitroimino-nitromethylene—azole or-azine heterocyclic compounds, insecticidal compositions containing them, and insecticidal methods of using them NIHON BAYER AGROCHEM K.K. (JP) 2001-10-02 US disclosed
US-6022967-A 1-NITRO-2-CARBOXYVINYL- OR 1-NITRO-2-(DIMETHYLAMINO)VINYL-SUBSTITUTED IMIDAZOLIDINES OR TETRAHYDROPYRIMIDINES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-08 US disclosed
US-5580889-A Insecticidal nitromethyl or niteoimino-heteromethyl-heterocyclics NIHON BAYER AGROCHEM K.K. (JP) 1996-12-03 US disclosed
US-5461167-A 2-chloro-5-chloromethyl thiazole; insecticide NIHON BAYER AGROCHEM K.K. (JP) 1995-10-24 US disclosed
US-5428032-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1995-06-27 US disclosed
US-5298507-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1994-03-29 US disclosed
US-5204360-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1993-04-20 US disclosed
US-5001138-A Insecticides NIHON TOKUSHU NOYAKU SEIZO, K.K. (JP) 1991-03-19 US disclosed
US-4742060-A 2-(NITROIMINO)- OR 2-(NITROMETHYLENE)-IMIDAZOLIDINES AS INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K. K. (JP) 1988-05-03 US disclosed