SCHEMBL19979961

SCHEMBL19979961

O=C(O)c1cccnc1-n1cncn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.53
KDM4E B2RXH2 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 5/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
BLM P54132 1/20 0.46
AGER Q15109 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NAPRT Q6XQN6 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 2/20 0.45
CYP2A6 P11509 1/20 0.42
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL885409 0.86 PARP1 (0.44) MYCKDM4EALDH1A1MAPTNAPRT
SCHEMBL19979962 0.82 CYP1A2 (0.46) KDM4ETDP1L3MBTL1CYP3A4LMNA
SCHEMBL29551359 0.79 MYC (0.57) MYCKDM4ETDP1KMT2AALDH1A1
SCHEMBL7090852 0.79 MYC (0.57) MYCKDM4ETDP1KMT2AALDH1A1
SCHEMBL30597933 0.78 MEN1 (0.56) KDM4EKMT2AALDH1A1L3MBTL1CYP3A4
SCHEMBL28608913 0.77 POLB (0.41) KDM4ETDP1KMT2AALDH1A1MAPT
SCHEMBL30982330 0.76 HCRTR1 (0.51) MYCTDP1KMT2AALDH1A1L3MBTL1
SCHEMBL403908 0.76 HCRTR1 (0.51) MYCTDP1KMT2AALDH1A1L3MBTL1
SCHEMBL22717707 0.75 MYC (0.53) MYCKDM4ETDP1KMT2AALDH1A1
SCHEMBL16155571 0.75 MYC (0.60) MYCKDM4ETDP1KMT2AALDH1A1

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
CN-116969925-B Heteroaryl-triazole compounds BAYER AG (DE) 2026-05-26 CN disclosed
CN-115003663-B Novel heteroaryl-triazole compounds as pesticides 拜耳公司 2024-04-30 CN disclosed
CN-116969925-A Heteroaryl-triazole compounds 拜耳公司 2023-10-31 CN disclosed
CN-116925043-A Heteroaryl-triazole compounds 拜耳公司 2023-10-24 CN disclosed
WO-2018050677-A1 HERBICIDAL PYRIDINES SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 WO disclosed