SCHEMBL17865385

SCHEMBL17865385

CC(C)CNC(=O)c1ccc(CCOc2ccc(F)c(-c3ccccc3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
FFAR4 Q5NUL3 7/20 0.43
FFAR1 O14842 5/20 0.43
PPARD Q03181 2/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 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
SCHEMBL17865394 0.82 HPGD (0.48) HPGDNPSR1NPC1RAB9AMEN1
SCHEMBL17865383 0.78 CYP2C9 (0.46) HPGDNPSR1MEN1KMT2AMAPT
SCHEMBL17865382 0.77 KMT2A (0.51) HPGDNPSR1NPC1RAB9AMEN1
SCHEMBL17865384 0.76 ROCK2 (0.49) HPGDNPSR1MEN1KMT2A
SCHEMBL17865381 0.76 HPGD (0.57) HPGDNPSR1PPARGPPARA
SCHEMBL17865392 0.75 HPGD (0.52) HPGDNPSR1NPC1RAB9AMEN1
SCHEMBL17865388 0.75 NPSR1 (0.48) HPGDNPSR1NPC1RAB9AMEN1
SCHEMBL17865398 0.71 ACACB (0.47) HPGDNPSR1MEN1KMT2AFFAR1
SCHEMBL18082335 0.71 NPC1 (0.71) HPGDNPSR1NPC1RAB9AKMT2A
SCHEMBL8738314 0.70 HPGD (0.66) HPGDNPSR1KMT2AMAPTSMN1; SMN2

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 HPGD 4335/4885NPSR1 1003/4885NPC1 3719/4885
US-20160192651-A1 PESTICIDE DDT, ACHE, KCNH1 HPGD 4335/4885NPSR1 1003/4885NPC1 3719/4885

“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.