SCHEMBL9066979

SCHEMBL9066979

CCNc1ncnc(NC)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
GAA P10253 3/20 0.41
POLB P06746 1/20 0.41
CYP1A2 P05177 4/20 0.39
CYP2C19 P33261 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
USP2 O75604 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GLA P06280 2/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
HSD17B10 Q99714 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MCL1 Q07820 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL6978430 0.91 LMNA (0.52) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL18067375 0.84 ALDH1A1 (0.41) GAAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8535385 0.83 EGFR (0.38) LMNAGAACYP1A2CYP2C19HTT
SCHEMBL17563550 0.81 CYP1A2 (0.38) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL11793081 0.81 LMNA (0.54) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL8166873 0.79 LMNA (0.61) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL14869406 0.79 LMNA (0.61) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL27747517 0.78 LMNA (0.40) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL7713854 0.78 GAA (0.53) LMNAGAAPOLBCYP1A2CYP2C19
SCHEMBL17563735 0.78 LMNA (0.41) LMNAGAAPOLBCYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1115757-A Herbicidal tetrazolinones BAYER AGROCHEM KK (JP) 1996-01-31 CN claimed
CN-1058489-C Herbicidal tetrazolinones BAYER AGROCHEM KK (JP) 2000-11-15 CN disclosed
US-5541336-A Herbicidal tetrazolinones NIHON BAYER AGROCHEM K.K. (JP) 1996-07-30 US disclosed
CN-1115757-A Herbicidal tetrazolinones BAYER AGROCHEM KK (JP) 1996-01-31 CN disclosed