SCHEMBL8139754

SCHEMBL8139754

O=C(O)c1ncc(-c2ccc(F)cc2F)o1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.48
ACKR3 P25106 6/20 0.44
SLC9A1 P19634 1/20 0.44
MGAM O43451 2/20 0.43
GAA P10253 2/20 0.43
SI P14410 2/20 0.43
MGAM2 Q2M2H8 2/20 0.43
FAAH O00519 2/20 0.43
KDM4A O75164 1/20 0.43
KDM5A P29375 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
KDM5B Q9UGL1 1/20 0.43
PDE4B Q07343 3/20 0.42
TTR P02766 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
DHFR P00374 1/20 0.42
CA1 P00915 1/20 0.42

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
SCHEMBL19814651 0.98 KMO (0.47) KMOACKR3SLC9A1MGAMGAA
Lithium Ion SCHEMBL28332477 0.85 ACKR3 (0.43) KMOACKR3SLC9A1MGAMGAA
SCHEMBL6834403 0.81 FAAH (0.61) SLC9A1MGAMGAASIMGAM2
SCHEMBL29775761 0.80 TSHR (0.44) ACKR3SLC9A1MGAMGAASI
SCHEMBL19814604 0.80 TSHR (0.44) ACKR3SLC9A1MGAMGAASI
SCHEMBL1505182 0.78 MAP4K4 (0.48) KMOMGAMGAASIMGAM2
SCHEMBL8141902 0.78 FAAH (0.56) GAAFAAHKDM4EMEN1ALDH1A1
SCHEMBL27702421 0.76 PDE4B (0.44) KMOSLC9A1MGAMGAASI
SCHEMBL12171800 0.75 MAOA (0.46) KMOGAAFAAHKDM4AKDM5A
SCHEMBL14638109 0.74 MGAM (0.41) KMOACKR3SLC9A1MGAMGAA

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
US-6096688-A Oxazole carboxamide herbicides AMERICAN CYANAMID COMPANY (US) 2000-08-01 US claimed
US-6096688-A Oxazole carboxamide herbicides AMERICAN CYANAMID COMPANY (US) 2000-08-01 US disclosed