SCHEMBL10495645

SCHEMBL10495645

CCc1cccc(CC)c1C=N

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 4/20 0.48
GABRB2 P47870 4/20 0.48
MGLL Q99685 1/20 0.34
PDK2 Q15119 1/20 0.34
CHAT P28329 1/20 0.34
KCNH2 Q12809 2/20 0.33
SCN5A Q14524 2/20 0.33
CTSB P07858 1/20 0.33
HTR1A P08908 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
DAO P14920 1/20 0.32
CACNA1C Q13936 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL10971364 0.87 GABRA1 (0.41) GABRA1GABRB2CHATTAAR1
SCHEMBL19880549 0.85 KMT2A (0.45) GABRA1GABRB2HTR1ATAAR1
SCHEMBL19779452 0.85 GABRA1 (0.40) GABRA1GABRB2KCNH2TAAR1
SCHEMBL19880520 0.80 GABRA1 (0.36) GABRA1GABRB2MAPTNPSR1L3MBTL1
SCHEMBL29249250 0.79 GABRA1 (0.52) GABRA1GABRB2MGLLPDK2KCNH2
SCHEMBL18242771 0.77 GABRA1 (0.50) GABRA1GABRB2MGLLPDK2KCNH2
SCHEMBL320588 0.77 GABRA1 (0.50) GABRA1GABRB2MGLLPDK2KCNH2
SCHEMBL1363486 0.77 GABRA1 (0.50) GABRA1GABRB2MGLLPDK2KCNH2
SCHEMBL18243445 0.77 GABRA1 (0.50) GABRA1GABRB2MGLLPDK2KCNH2
SCHEMBL11745960 0.73 GABRA1 (0.46) GABRA1GABRB2MGLLPDK2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4798618-A Novel chloroacetanilide derivatives and herbicides containing the same for use in paddy field AGRO-KANESHO CO., LTD. (JP) 1989-01-17 US disclosed
US-4491672-A Preparation of aromatic azomethines BASF AKTIENGESELLSCHAFT (DE) 1985-01-01 US disclosed