SCHEMBL30739899

SCHEMBL30739899

N#Cc1cc(F)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 10/20 0.61
MAPT P10636 5/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.55
GAA P10253 2/20 0.55
POLB P06746 1/20 0.55
SMN1; SMN2 Q16637 7/20 0.54
LMNA P02545 3/20 0.54
TP53 P04637 2/20 0.54
CYP3A4 P08684 2/20 0.54
MAPK1 P28482 2/20 0.54
PPARG P37231 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
PKM P14618 1/20 0.54
TSHR P16473 1/20 0.54
NFKB1 P19838 1/20 0.54
CYP2C19 P33261 1/20 0.54
THPO P40225 1/20 0.54

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
SCHEMBL18147742 1.00 RORC (0.61) RORCMAPTKMT2AMEN1GAA
SCHEMBL21020973 0.89 VCAM1 (0.50) RORCMAPTKMT2AMEN1GAA
SCHEMBL18146151 0.86 RORC (0.70) RORCMAPTKMT2AMEN1GAA
SCHEMBL7130616 0.85 RORC (0.70) RORCMAPTKMT2AMEN1GAA
SCHEMBL18146244 0.85 RORC (0.76) RORCMAPTKMT2AMEN1GAA
SCHEMBL30739580 0.85 RORC (0.76) RORCMAPTKMT2AMEN1GAA
SCHEMBL18147048 0.83 RORC (0.72) RORCMAPTKMT2AMEN1GAA
SCHEMBL18146159 0.82 RORC (0.68) RORCMAPTKMT2AMEN1GAA
SCHEMBL18146401 0.81 MAOB (0.46) MAPTKMT2AMEN1GAASMN1; SMN2
SCHEMBL30369378 0.81 RORC (0.76) RORCMAPTKMT2AMEN1GAA

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
CN-118044519-A Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-05-17 CN disclosed
CN-110072842-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 科迪华农业科技有限责任公司 2024-02-02 CN disclosed