SCHEMBL19978124

SCHEMBL19978124

CC(C)(C)C[Si](C)(C)C1C=C(CC2CCCCC2)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.37
RAB9A P51151 2/20 0.33
ALDH1A1 P00352 1/20 0.33
NPC1 O15118 1/20 0.30
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL19960591 0.88 IDO1 (0.33) IDO1RAB9AALDH1A1
SCHEMBL19966060 0.82 RAB9A (0.35) IDO1RAB9AALDH1A1NPC1BCHE
SCHEMBL19960590 0.75
SCHEMBL6406116 0.71 HTR6 (0.38) IDO1RAB9AALDH1A1BCHEACHE
SCHEMBL6400756 0.67 DRD2 (0.34) IDO1RAB9AALDH1A1BCHEACHE
SCHEMBL6402355 0.67 DRD2 (0.34) IDO1RAB9AALDH1A1BCHEACHE
Hydrochloric Acid SCHEMBL6407042 0.67 BCHE (0.33) IDO1RAB9AALDH1A1NPC1BCHE
SCHEMBL6407040 0.67 BCHE (0.33) IDO1RAB9AALDH1A1BCHEACHE
SCHEMBL19960575 0.66
SCHEMBL6408781 0.66 MEN1 (0.31) IDO1ALDH1A1BCHEACHE

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
US-20180079841-A1 METALLOCENE SUPPORTED CATALYST AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME LG CHEM, LTD. (KR) 2018-03-22 US 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 (1 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-20180079841-A1 METALLOCENE SUPPORTED CATALYST AND METHOD FOR PREPARING POLYOLEFIN USING THE SAME PCBP1, SOD1, PCLAF IDO1 3727/4885RAB9A 4118/4885ALDH1A1 2034/4885

“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.