SCHEMBL7981962

SCHEMBL7981962

Fc1cc(CNCCCS)ccn1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.47
▸ KCNH3 Q9ULD8 5/20 0.43
▸ CHRM2 P08172 3/20 0.39
▸ ROCK1 Q13464 4/20 0.38
▸ SCN8A Q9UQD0 1/20 0.37
▸ KCNH2 Q12809 2/20 0.35
▸ KCNQ2 O43526 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ADRA1D P25100 1/20 0.35
▸ ADRA1A P35348 1/20 0.35
▸ ADRA1B P35368 1/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ ALDH1A1 P00352 1/20 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
SCHEMBL10483900 0.84 LOXL2 (0.56) LOXL2KCNH3CHRM2ROCK1SCN8A
SCHEMBL10483895 0.83 LOXL2 (0.59) LOXL2KCNH3CHRM2ROCK1SCN8A
SCHEMBL24437740 0.78 LOXL2 (0.41) LOXL2KCNH3CHRM2ALDH1A1
SCHEMBL7992413 0.75 ALDH1A1 (0.56) CHRM2CYP3A4ALDH1A1
SCHEMBL7996321 0.75 CHRM2 (0.43) CHRM2SCN8A
SCHEMBL21592231 0.75 CYP19A1 (0.47) TSHRALDH1A1
SCHEMBL9611257 0.74 SHMT2 (0.44) CHRM2ROCK1KCNH2ROCK2
SCHEMBL12536053 0.72 LOXL2 (0.57) LOXL2KCNH3KCNH2KCNQ2CYP3A4
SCHEMBL13689611 0.72 LOXL2 (0.57) LOXL2KCNH3KCNH2KCNQ2CYP3A4
SCHEMBL27341502 0.72 LOXL2 (0.57) LOXL2KCNH3KCNH2KCNQ2CYP3A4

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 12 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-5750704-A INSECTICIDES NIHON BAYER AGROCHEM K.K. (JP) 1998-05-12 — — 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-4845106-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-07-04 — — 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
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 — — EP disclosed
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