SCHEMBL21020337

SCHEMBL21020337

Cc1ccc(N(C)c2cccc3c2sc2c(C(C)(C)C)cccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 3/20 0.32
HSD17B2 P37059 3/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL21020334 0.89 NR1I2 (0.35)
SCHEMBL21021503 0.89 KIF11 (0.33) ALDH1A1TSHR
SCHEMBL21020478 0.88 ENPP1 (0.33) HSD17B1HSD17B2ALDH1A1TSHR
SCHEMBL21021506 0.88 POLB (0.32)
SCHEMBL21020336 0.85 CHKA (0.31)
SCHEMBL21020338 0.85 DHFR (0.32)
SCHEMBL21020335 0.85
SCHEMBL21021508 0.85 HDAC6 (0.31)
SCHEMBL20650783 0.85
SCHEMBL20172907 0.82 KIF11 (0.35) ALDH1A1TSHR

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-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2019-05-23 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-20190152919-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, ESR1 HSD17B1 2644/4885HSD17B2 1421/4885ALDH1A1 1103/4885

“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.