SCHEMBL31344741

SCHEMBL31344741

NC(=NO)c1ncc(C(F)(F)F)cc1Sc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.50
ALDH1A1 P00352 10/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
RAB9A P51151 1/20 0.42
HPGD P15428 2/20 0.40
GLA P06280 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
XBP1 P17861 1/20 0.40
USP2 O75604 1/20 0.36
GAA P10253 2/20 0.35
PLAU P00749 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ICAM1 P05362 1/20 0.34
SELE P16581 1/20 0.34

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
SCHEMBL31344739 0.80 PLAU (0.36) ALDH1A1PLAUKDM4EICAM1SELE
SCHEMBL31344713 0.80 NPSR1 (0.43) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL2170642 0.73 NPSR1 (0.65) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL2170639 0.73 NPSR1 (0.65) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL31344736 0.72 NPSR1 (0.48) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL5227027 0.72 ALDH1A1 (0.69) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL31344703 0.68 NPSR1 (0.40) NPSR1ALDH1A1KMT2ARAB9AHPGD
SCHEMBL7675935 0.66 L3MBTL1 (0.42) NPSR1ALDH1A1KMT2AMEN1RAB9A
SCHEMBL8108703 0.65 ALDH1A1 (0.53) ALDH1A1KMT2AMEN1HPGDMAPT
SCHEMBL7671680 0.65 KMT2A (0.51) NPSR1ALDH1A1KMT2AMEN1RAB9A

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
EP-4724447-A1 SYNTHESIS OF CYCLIC ACYL SULFOXIMINES Syngenta Crop Protection AG (CH) 2026-04-15 EP disclosed
WO-2024252006-A1 SYNTHESIS OF CYCLIC ACYL SULFOXIMINES SYNGENTA CROP PROTECTION AG (CH) 2024-12-12 WO disclosed