SCHEMBL7994396

SCHEMBL7994396

CCCCC1CCC=CCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.58
MAPK1 P28482 2/20 0.42
HTT P42858 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
HRH3 Q9Y5N1 1/20 0.34
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
EPHX1 P07099 1/20 0.32
CHRM1 P11229 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
HTR1A P08908 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2A P08913 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA2B P18089 1/20 0.32
CHRM3 P20309 1/20 0.32

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
SCHEMBL16567992 0.91 CYP1A2 (0.61) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL7994838 0.91 CYP1A2 (0.61) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL1524848 0.89 CYP1A2 (0.46) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL42267 0.85 CYP1A2 (0.58) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL7980529 0.84 CYP1A2 (0.39) CYP1A2MAPK1LMNAMAPTHRH3
SCHEMBL17941536 0.83 CYP1A2 (0.52) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL17941530 0.83 CYP1A2 (0.52) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL27288023 0.83 CYP1A2 (0.56) CYP1A2MAPK1HTTLMNAMAPT
SCHEMBL1524898 0.82 CYP1A2 (0.40) CYP1A2MAPK1HTTLMNAPOLB
SCHEMBL5691762 0.81 CYP1A2 (0.74) CYP1A2MAPK1HTTLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6277790-B1 APPLYING PLANTS, SEEDS, SOILS OR ENVIRONMENT BASF AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed