SCHEMBL16024622

SCHEMBL16024622

CCCCCCCCCCc1ccc2cc3oc4cc5cc6c(cc5cc4c3cc2c1)oc1cc2ccc(-c3ccccc3)cc2cc16

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.41
▸ RARB P10826 8/20 0.41
▸ RARA P10276 2/20 0.41
▸ CNR1 P21554 2/20 0.41
▸ CNR2 P34972 2/20 0.41
▸ RARG P13631 1/20 0.41
▸ PSMB5 P28074 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TRPV1 Q8NER1 1/20 0.40
▸ BCHE P06276 1/20 0.38
▸ SPHK1 Q9NYA1 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL16024611 1.00 HSD11B1 (0.41) HSD11B1RARBRARACNR1CNR2
SCHEMBL16024627 0.99 HSD11B1 (0.40) HSD11B1RARBRARACNR1CNR2
SCHEMBL16024631 0.99 HSD11B1 (0.40) HSD11B1RARBRARACNR1CNR2
SCHEMBL16981570 0.90 CNR1 (0.40) HSD11B1RARBRARACNR1CNR2
SCHEMBL16807672 0.89 SPHK2 (0.41) CNR1CNR2SPHK1
SCHEMBL16024615 0.88 ESR1 (0.42) ALDH1A1HSD17B10
SCHEMBL15223418 0.88 ESR1 (0.42) ALDH1A1HSD17B10
SCHEMBL18352172 0.88 ESR1 (0.42) ALDH1A1HSD17B10
SCHEMBL15223412 0.88 ESR1 (0.42) ALDH1A1HSD17B10
SCHEMBL15223469 0.88 ESR1 (0.42) ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9853225-B2 Chalcogen-containing organic compound and a use thereof JNC CORPORATION (JP) 2017-12-26 — — US disclosed
US-20160013425-A1 A CHALCOGEN-CONTAINING ORGANIC COMPOUND AND A USE THEREOF PI-CRYSTAL INC. (JP) 2016-01-14 — — US disclosed
WO-2014136827-A1 CHALCOGEN-CONTAINING ORGANIC COMPOUND AND USE THEREFOR JNC株式会社 (JP) 2014-09-12 — — 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-20160013425-A1 A CHALCOGEN-CONTAINING ORGANIC COMPOUND AND A USE THEREOF SCO2, SOD1, GPX1 HSD11B1 244/4885RARB 2481/4885RARA 2393/4885

“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.

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