SCHEMBL17865384

SCHEMBL17865384

CC(C)CNC(=O)c1ccc(CCOc2cccc(OC(F)(F)F)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.49
ROCK1 Q13464 1/20 0.49
MAPK14 Q16539 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
MLYCD O95822 1/20 0.48
GPR139 Q6DWJ6 1/20 0.48
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GAA P10253 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TRPV1 Q8NER1 4/20 0.46
EPHX2 P34913 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
HDAC8 Q9BY41 1/20 0.44
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL17865381 0.89 HPGD (0.57) MLYCDHPGDNPSR1TRPV1EPHX2
SCHEMBL15839273 0.86 RAF1 (0.46) ROCK2ROCK1KMT2AGPR139GAA
SCHEMBL17865389 0.85 MRGPRX4 (0.53) MAPK14POLB
SCHEMBL17865382 0.84 KMT2A (0.51) KMT2AMEN1HPGDNPSR1GAA
SCHEMBL17865393 0.81 MRGPRX4 (0.51) MAPK14KMT2ANR1H4
SCHEMBL15835747 0.79 RAF1 (0.40) KMT2AMEN1HPGDGAAHSD17B10
SCHEMBL17660263 0.79 MLYCD (0.66) KMT2AMLYCDHPGDNPSR1GAA
SCHEMBL17865398 0.78 ACACB (0.47) ROCK2ROCK1KMT2AMEN1HPGD
SCHEMBL15839324 0.77 RAF1 (0.44) ROCK2ROCK1GPR139
SCHEMBL15839264 0.77 GPR132 (0.45) ROCK2ROCK1GPR139

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10299475-B2 Pesticide ISHIHARA SANGYO KAISHA, LTD. (JP) 2019-05-28 US disclosed
US-20160192651-A1 PESTICIDE ISHIHARA SANGYO KAISHA, LTD. (JP) 2016-07-07 US disclosed
EP-3037408-A1 HARMFUL ORGANISM CONTROL AGENT Ishihara Sangyo Kaisha, Ltd. (JP) 2016-06-29 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10299475-B2 Pesticide DDT, ACHE, KCNH1 ROCK2 1150/4885ROCK1 1426/4885MAPK14 2209/4885
US-20160192651-A1 PESTICIDE DDT, ACHE, KCNH1 ROCK2 1150/4885ROCK1 1426/4885MAPK14 2209/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.