SCHEMBL9737411

SCHEMBL9737411

COc1c(Cl)cccc1N(C(N)=O)c1cc(C)cc(C(F)(F)F)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
SCN9A Q15858 1/20 0.34
RORC P51449 2/20 0.34
KMT2A Q03164 3/20 0.33
IGF1R P08069 3/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GPBAR1 Q8TDU6 4/20 0.33
PTGS2 P35354 2/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NOTUM Q6P988 1/20 0.32
LOX P28300 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
SCHEMBL9737677 0.75 MAPK14 (0.45) LMNAGPBAR1
SCHEMBL9738307 0.70 LMNA (0.37) NPSR1KDM4ELMNACYP1A2CYP2C19
SCHEMBL9737076 0.68 MAPK14 (0.43) NPSR1LMNACYP1A2CYP2C19KMT2A
SCHEMBL14053556 0.66 ALDH1A1 (0.40) KDM4EKMT2AMEN1ALDH1A1HPGD
SCHEMBL9737597 0.65 GAA (0.43) NPSR1LMNAKMT2AMEN1ALDH1A1
SCHEMBL9739327 0.65 SDHB (0.39) KDM4ELMNAALDH1A1HPGDHSD17B10
SCHEMBL9740354 0.65 MAPK14 (0.39) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9737747 0.65 PTGES (0.36) NPSR1IGF1RGAAMAPT
SCHEMBL9738360 0.65 MAPK14 (0.41) LMNAGAANPC1RAB9A
SCHEMBL9737104 0.65 LMNA (0.40) LMNAKMT2AMEN1ALDH1A1HPGD

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-5159078-A Herbicides, plant growth regulator CIBA-GEIGY CORPORATION (US) 1992-10-27 US disclosed
US-4966622-A HERBICIDES, PLANT GROWTH REGULATORS CIBA-GEIGY CORPORATION (US) 1990-10-30 US disclosed