SCHEMBL7992555

SCHEMBL7992555

Cc1ccc(CNCCNCc2ccc(C)o2)o1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.78
MEN1 O00255 1/20 0.48
CHRM4 P08173 1/20 0.48
CHRM5 P08912 1/20 0.48
CHRM1 P11229 1/20 0.48
CYP2C9 P11712 1/20 0.48
CHRM3 P20309 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 2/20 0.43
POLB P06746 2/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
OPRM1 P35372 1/20 0.40
HTR6 P50406 1/20 0.40
ALOX5 P09917 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HTT P42858 2/20 0.38
PKM P14618 1/20 0.38
AMY1A P0DUB6 1/20 0.38

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
SCHEMBL10864363 0.88 CHRM2 (0.73) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL6616830 0.88 CHRM2 (0.68) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL8748293 0.88 CHRM2 (0.68) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL14376843 0.84 CHRM2 (0.63) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL15443940 0.84 CHRM2 (0.58) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL12693912 0.82 CHRM2 (0.60) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL6142706 0.82 CHRM2 (0.60) CHRM2MEN1KMT2AMAPTTDP1
SCHEMBL12888711 0.80 CHRM2 (0.58) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL15743739 0.80 CHRM2 (0.58) CHRM2MEN1CHRM4CHRM5CHRM1
SCHEMBL5442009 0.79 CHRM2 (0.66) CHRM2MEN1KMT2AMAPTPOLB

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 11 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