SCHEMBL9529580

SCHEMBL9529580

C#CCOc1cc(N=C=O)ccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 1/20 0.43
TSHR P16473 2/20 0.40
HPGD P15428 2/20 0.40
PGK1 P00558 1/20 0.38
CYP3A4 P08684 2/20 0.36
TRPA1 O75762 1/20 0.36
HTR2C P28335 3/20 0.35
HTR2A P28223 2/20 0.35
NR1I2 O75469 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
TACR2 P21452 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A2 P23975 1/20 0.35
ADORA1 P30542 1/20 0.35
SLC6A4 P31645 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
SCHEMBL9530684 0.80 LMNA (0.43) MAPK1TDP1LMNATSHRHPGD
SCHEMBL9528156 0.78 MAPK1 (0.51) MAPK1TDP1TSHRHPGDCYP3A4
SCHEMBL282107 0.76 MAPK1 (0.61) MAPK1TDP1TSHRHPGDCYP3A4
SCHEMBL1477394 0.75 TSHR (0.54) MAPK1LMNATSHRHPGDPGK1
SCHEMBL16774344 0.74 PGK1 (0.53) MAPK1LMNATSHRHPGDPGK1
SCHEMBL7081041 0.74 LMNA (0.41) LMNATSHRHPGDPGK1HTR2C
SCHEMBL1477058 0.72 LMNA (0.44) LMNATSHRHPGDPGK1HTR2C
SCHEMBL10977285 0.72 LMNA (0.48) LMNATSHRHPGDPGK1HTR2C
SCHEMBL8878096 0.72 SYK (0.49) LMNATSHRHPGDPGK1CYP3A4
SCHEMBL1555247 0.72 MAPK1 (0.56) MAPK1TDP1TSHRPGK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0371240-B1 USE OF N-PHENYL-SUBSTITUTED OXAZINDIONES AS HERBICIDES AND N-PHENYL-SUBSTITUTED OXAZINDIONES AND SOME PROCESSES FOR THEIR PRODUCTION BAYER AG (DE) 1993-06-16 EP disclosed
US-5164498-A Herbicidal N-phenyl-substituted oxazinediones BAYER AKTIENGESELLSCHAFT (DE) 1992-11-17 US disclosed
US-5061310-A HERBICIDAL N-PHENYL-SUBSTITUTED OXAZINEDIONES AND OXAZINONETHIONES BAYER AKTIENGESELLSCHAFT (DE) 1991-10-29 US disclosed
EP-0371240-A1 Use of N-phenyl-substituted oxazindiones as herbicides and N-phenyl-substituted oxazindiones and some processes for their production BAYER AG (DE) 1990-06-06 EP disclosed
EP-0290902-A2 Condensed (thio)hydantoins BAYER AG (DE) 1988-11-17 EP disclosed