SCHEMBL20892298

SCHEMBL20892298

COCc1ccc(C(C)(C)S)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.38
▸ IDO1 P14902 5/20 0.36
▸ ESR1 P03372 4/20 0.36
▸ ESR2 Q92731 4/20 0.36
▸ POLB P06746 1/20 0.35
▸ NR4A2 P43354 1/20 0.34
▸ RXRA P19793 1/20 0.34
▸ RXRB P28702 1/20 0.34
▸ AGXT P21549 2/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ PDK2 Q15119 1/20 0.32

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
SCHEMBL780050 0.82 APP (0.53) APPPOLBNR4A2RXRARXRB
SCHEMBL10601214 0.82 ESR1 (0.48) APPIDO1ESR1ESR2POLB
SCHEMBL11308991 0.79 APP (0.41) APPIDO1ESR1ESR2POLB
SCHEMBL18574373 0.79 APP (0.36) APPIDO1ESR1ESR2NR4A2
SCHEMBL10357375 0.78 RORC (0.39) APPIDO1ESR1ESR2POLB
SCHEMBL12421573 0.78 ESR1 (0.41) APPIDO1ESR1ESR2POLB
SCHEMBL134443 0.78 IDO1 (0.46) APPIDO1AGXTPTGS2
SCHEMBL10180151 0.77 NPC1 (0.47) APPESR1ESR2POLB
SCHEMBL791859 0.76 IDO1 (0.63) IDO1KMT2A
SCHEMBL26078639 0.75 TSHR (0.40) ESR1ESR2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10815322-B2 Metallocene supported catalyst and method for preparing polypropylene using the same LG CHEM, LTD. (KR) 2020-10-27 — — US disclosed
US-20190106516-A1 Metallocene Supported Catalyst And Method For Preparing Polypropylene Using The Same LG CHEM, LTD. (KR) 2019-04-11 — — 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-10815322-B2 Metallocene supported catalyst and method for preparing polypropylene using the same PPOX, PCNA, MUS81 APP 2799/4885IDO1 2452/4885ESR1 2135/4885

“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.

Send feedback