SCHEMBL7489479

SCHEMBL7489479

Cn1nc(-c2ccc(Cl)cc2F)c(Cl)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.45
GRM2 Q14416 1/20 0.39
RORC P51449 3/20 0.38
KDM4C Q9H3R0 5/20 0.37
KDM5B Q9UGL1 1/20 0.37
MAPT P10636 3/20 0.36
HSD11B1 P28845 1/20 0.36
PDE5A O76074 1/20 0.36
PDE1A P54750 1/20 0.36
PDE1B Q01064 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE7A Q13946 1/20 0.36
PDE1C Q14123 1/20 0.36
PDE3A Q14432 1/20 0.36
ADCY10 Q96PN6 1/20 0.36
MARS1 P56192 1/20 0.36
EIF4E P06730 1/20 0.35
SLC34A1 Q06495 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL7474145 0.86 ALDH1A1 (0.40) KMOMAPTADCY10SLC34A1TP53
SCHEMBL7484830 0.79 ADCY10 (0.33) RORCADCY10MARS1
SCHEMBL7486295 0.79 ADCY10 (0.37) RORCMAPTADCY10
SCHEMBL7688642 0.78 GRM5 (0.36) ADCY10
SCHEMBL8569766 0.76 HSD11B1 (0.47) GRM2KDM4CMAPTHSD11B1SLC34A1
SCHEMBL9531790 0.76 PTGS2 (0.37) KMOHSD11B1SLC34A1
SCHEMBL7490533 0.75 F2 (0.36)
SCHEMBL7490538 0.75 F2 (0.36)
SCHEMBL8626557 0.75 HSD11B1 (0.38) GRM2HSD11B1SLC34A1
SCHEMBL10955444 0.74 P2RX7 (0.42) MAPTSLC34A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0769008-B1 PYRAZOLE DERIVATIVES AS HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2002-05-22 EP disclosed