SCHEMBL30835582

SCHEMBL30835582

COc1cccc(C(CN)c2cnn(C)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 1/20 0.44
FGFR4 P22455 1/20 0.44
FGFR3 P22607 1/20 0.44
PKM P14618 1/20 0.43
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
OPRM1 P35372 1/20 0.41
DRD3 P35462 1/20 0.41
AOC3 Q16853 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CASR P41180 1/20 0.39
PDE4B Q07343 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
ROCK2 O75116 2/20 0.38
CHEK1 O14757 1/20 0.38
RPS6KA5 O75582 1/20 0.38
MAP4K4 O95819 1/20 0.38

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
SCHEMBL3905884 0.80 TAAR1 (0.57) AOC3L3MBTL1CASRMTNR1AMTNR1B
SCHEMBL31568314 0.80 FGFR2 (0.57) FGFR2FGFR4FGFR3PKMAOC3
SCHEMBL7420872 0.78 AOC3 (0.50) AOC3L3MBTL1CASRMTNR1AMTNR1B
SCHEMBL30835603 0.76 FGFR2 (0.44) FGFR2FGFR4FGFR3PKMAOC3
SCHEMBL2806820 0.73 HTR2A (0.62) AOC3L3MBTL1CASRMTNR1AMTNR1B
SCHEMBL7153016 0.70 AOC3 (0.69) AOC3L3MBTL1ROCK2CHEK1RPS6KA5
SCHEMBL1445942 0.70 AOC3 (0.69) AOC3L3MBTL1ROCK2CHEK1RPS6KA5
SCHEMBL6001101 0.70 MTNR1A (0.55) AOC3MEN1KMT2AL3MBTL1CASR
SCHEMBL9639193 0.70 AOC3 (0.69) AOC3L3MBTL1ROCK2CHEK1RPS6KA5
SCHEMBL9212842 0.70 AOC3 (0.51) AOC3L3MBTL1CASRROCK2CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4594310-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2025-08-06 EP disclosed
CN-119998270-A Microbiocidal pyrazole derivatives 先正达农作物保护股份公司 2025-05-13 CN disclosed
WO-2024068950-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-04-04 WO disclosed