SCHEMBL19981098

SCHEMBL19981098

COc1ccc2c(c1)c1c(n2S(C)(C)C)-c2ccccc2C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PGR P06401 1/20 0.38
HTR6 P50406 4/20 0.38
MTNR1A P48039 2/20 0.35
MTNR1B P49286 2/20 0.35
PDK2 Q15119 2/20 0.35
GRIK2 Q13002 1/20 0.35
ALOX15 P16050 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PDE4B Q07343 2/20 0.35
PDE4D Q08499 2/20 0.35
POLB P06746 1/20 0.34

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
SCHEMBL19978096 0.84 ALDH1A1 (0.51) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL19978106 0.78 GRIK2 (0.40) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL19978115 0.76 GRIK2 (0.39) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL19250390 0.72 DRD2 (0.47) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL19250255 0.67 DRD2 (0.47) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL12393746 0.66 PDK2 (0.59) KDM4EALDH1A1MEN1KMT2APGR
SCHEMBL19978147 0.66 PDK2 (0.64) KDM4EALDH1A1MEN1KMT2APGR
SCHEMBL29853561 0.66 PDK2 (0.59) KDM4EALDH1A1MEN1KMT2APGR
SCHEMBL13776774 0.66 CYP1A2 (0.46) KDM4EALDH1A1MEN1KMT2APGR
SCHEMBL19675658 0.66 MEN1 (0.43) KDM4EALDH1A1MEN1MAPTHTT

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 KDM4E 2644/4885ALDH1A1 2034/4885MEN1 1003/4885

“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.