SCHEMBL23409685

SCHEMBL23409685

CC(C)(O)c1cc(Cl)ccc1-c1cc(-c2ccccc2)sc1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 5/20 0.46
HSD17B2 P37059 4/20 0.41
PGR P06401 1/20 0.41
ESR1 P03372 4/20 0.39
ESR2 Q92731 1/20 0.38
PTP4A3 O75365 2/20 0.36
PTP4A2 Q12974 1/20 0.35
PTP4A1 Q93096 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
IKBKB O14920 1/20 0.34
S1PR1 P21453 1/20 0.33
CHRM1 P11229 1/20 0.33
CASR P41180 1/20 0.33
SNCA P37840 1/20 0.33

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
SCHEMBL31497075 0.79 PGR (0.44) PGRMEN1KMT2ACHRM1
SCHEMBL23409686 0.74 MAPT (0.53) HSD17B1MAPTMEN1NPC1RAB9A
SCHEMBL119652 0.74 HSD17B1 (0.58) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL11525349 0.74 HSD17B1 (0.58) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL11521978 0.74 HSD17B1 (0.58) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL30381930 0.73 HSD17B1 (0.40) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL23447126 0.73 SLC6A4 (0.51) MAPTMEN1NPC1RAB9AKMT2A
Hydrogen Sulfide SCHEMBL3010970 0.72 HSD17B1 (0.57) HSD17B1HSD17B2ESR1ESR2PTP4A3
SCHEMBL30381261 0.72 ALDH1A1 (0.56) MAPTMEN1NPC1RAB9AKMT2A
SCHEMBL24730410 0.72 PGR (0.47) HSD17B1HSD17B2PGRMAPTMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230046046-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-02-16 US disclosed
EP-4066289-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2022-10-05 EP disclosed
CN-114730843-A Compounds for electronic devices 默克专利有限公司 2022-07-08 CN disclosed
WO-2021104749-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-06-03 WO disclosed
WO-2021104749-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-06-03 WO 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-20230046046-A1 COMPOUNDS FOR ELECTRONIC DEVICES ETV6, CYP2C19, ESR1 HSD17B1 1130/4885HSD17B2 552/4885PGR 681/4885

“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.