SCHEMBL31330718

SCHEMBL31330718

O=C1OCc2nc(C(F)(F)F)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
TYMS P04818 1/20 0.35
CYP1A2 P05177 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PRF1 P14222 3/20 0.35
PDE3B Q13370 2/20 0.34
PDE3A Q14432 2/20 0.34
CXCR4 P61073 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MAT2A P31153 1/20 0.32

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
SCHEMBL31064766 0.78 KDM4E (0.33) KDM4ECYP2C19PDE3BPDE3ACXCR4
SCHEMBL31040882 0.74 PSMB5 (0.36) KDM4EPDE3BPDE3ACXCR4
SCHEMBL21223287 0.74 PSMB5 (0.36) KDM4EPDE3BPDE3ACXCR4
SCHEMBL29875581 0.73 GRM5 (0.37) MAOBKDM4EHPGDCYP2C19HSD17B10
SCHEMBL21223411 0.73 GRM5 (0.37) MAOBKDM4EHPGDCYP2C19HSD17B10
SCHEMBL2198651 0.73 CYP2C19 (0.46) MAOAMAOBKDM4EALDH1A1MAPT
SCHEMBL27002384 0.73 MAOA (0.39) MAOAMAOBKDM4EALDH1A1MAPT
SCHEMBL31064325 0.72 KDM4E (0.33) KDM4ECXCR4
SCHEMBL29957001 0.70 KCNJ1 (0.42) MAOAMAOBKDM4EALDH1A1MAPT
SCHEMBL2197606 0.70 KCNJ1 (0.42) MAOAMAOBKDM4EALDH1A1MAPT

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-4743443-A1 CHEMICAL PROCESS Syngenta Crop Protection AG (CH) 2026-05-20 EP disclosed
WO-2025012283-A1 CHEMICAL PROCESS SYNGENTA CROP PROTECTION AG (CH) 2025-01-16 WO disclosed