SCHEMBL17865382

SCHEMBL17865382

CC(C)CNC(=O)c1ccc(CCOc2cccc(Br)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 2/20 0.51
HPGD P15428 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
HSD17B10 Q99714 2/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 5/20 0.48
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 1/20 0.46
LMNA P02545 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL17865384 0.84 ROCK2 (0.49) KMT2AMEN1HPGDNPSR1HSD17B10
SCHEMBL14967130 0.83 MAPT (0.54) KMT2AMEN1GAAKDM4EALDH1A1
SCHEMBL17865398 0.80 ACACB (0.47) KMT2AMEN1HPGDNPSR1HSD17B10
SCHEMBL14966807 0.79 MRGPRX4 (0.60) KMT2AMEN1GAAKDM4EALDH1A1
SCHEMBL17865383 0.79 CYP2C9 (0.46) KMT2AMEN1HPGDNPSR1HSD17B10
SCHEMBL17865392 0.78 HPGD (0.52) KMT2AMEN1HPGDNPSR1HSD17B10
SCHEMBL17865385 0.77 HPGD (0.47) KMT2AMEN1HPGDNPSR1SMN1; SMN2
SCHEMBL14966541 0.76 LMNA (0.41) HPGDKDM4EALDH1A1SMN1; SMN2POLB
SCHEMBL17865381 0.76 HPGD (0.57) HPGDNPSR1
SCHEMBL31055430 0.76 KMT2A (0.78) KMT2AMEN1HPGDHSD17B10GAA

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 KMT2A 47/4885MEN1 2220/4885HPGD 4335/4885
US-20160192651-A1 PESTICIDE DDT, ACHE, KCNH1 KMT2A 47/4885MEN1 2220/4885HPGD 4335/4885

“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.