SCHEMBL7995930

SCHEMBL7995930

Cc1ccc(CNC(C)CS)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
HDAC4 P56524 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
NAMPT P43490 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CD274 Q9NZQ7 2/20 0.34
PLA2G7 Q13093 1/20 0.33
ADRB2 P07550 1/20 0.33
CDK2 P24941 1/20 0.33
CDK9 P50750 1/20 0.33
VNN1 O95497 1/20 0.33
PDCD1 Q15116 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
SCHEMBL14318800 0.83 CD274 (0.45) PDE10AMEN1LMNAKMT2AGAA
SCHEMBL12779730 0.82 CD274 (0.45) PDE10AMEN1LMNAKMT2AGAA
SCHEMBL7995345 0.80 ADRB2 (0.34) SIGMAR1ALDH1A1CD274ADRB2BCHE
SCHEMBL10864606 0.77 CYP1A2 (0.55) KMT2ASMN1; SMN2ALDH1A1
SCHEMBL25523398 0.74 ADRB2 (0.45) PDE10AMEN1LMNAKMT2AGAA
SCHEMBL7981959 0.72 GAA (0.43) PDE10AGAAHDAC4HDAC1HDAC6
SCHEMBL3038971 0.72 GAA (0.45) PDE10AMEN1LMNAKMT2AGAA
SCHEMBL19608557 0.72
SCHEMBL10863319 0.72 MEN1 (0.46) MEN1LMNAKMT2AGAASIGMAR1
SCHEMBL7999060 0.70 CHRM2 (0.43) PDE10AMEN1KMT2AGAANAMPT

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