SCHEMBL18117612

SCHEMBL18117612

O=S(=O)(Oc1ccc2oc3cccc4ccc1c2c43)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.35
▸ ABCG2 Q9UNQ0 3/20 0.32
▸ CNR2 P34972 1/20 0.31
▸ DRD2 P14416 4/20 0.31
▸ DRD4 P21917 3/20 0.31
▸ DRD3 P35462 3/20 0.31
▸ HTR5A P47898 1/20 0.31
▸ CDC14B O60729 1/20 0.31
▸ CDC14A Q9UNH5 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ DRD1 P21728 1/20 0.30
▸ DRD5 P21918 1/20 0.30
▸ PDE4A P27815 1/20 0.30
▸ PDE4C Q08493 1/20 0.30
▸ PDE4D Q08499 1/20 0.30

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
SCHEMBL17795754 0.87 — —
SCHEMBL18117623 0.83 HSD11B1 (0.36) HSD11B1CNR2DRD2DRD4DRD3
SCHEMBL24735370 0.83 ABCG2 (0.41) ABCG2CDC14BCDC14ATDP1L3MBTL1
SCHEMBL31336105 0.83 ABCG2 (0.41) ABCG2CDC14BCDC14ATDP1L3MBTL1
SCHEMBL24627968 0.81 CDC14B (0.38) HSD11B1ABCG2CNR2DRD2DRD4
SCHEMBL17795753 0.79 — —
SCHEMBL17795603 0.78 — —
SCHEMBL23287880 0.78 DRD2 (0.36) HSD11B1DRD2
SCHEMBL24628085 0.77 MAOA (0.38) HSD11B1CNR2DRD2DRD4DRD3
SCHEMBL24627972 0.76 CNR2 (0.35) HSD11B1CNR2CDC14BCDC14A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10043980-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-08-07 — — US disclosed
US-20160293847-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-06 — — US disclosed
US-20160293847-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-10-06 — — US disclosed
EP-3075731-A1 PHENANTHRO[4,5-BCA]FURAN COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2016-10-05 — — EP 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 (2 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-10043980-B2 Compound and organic light-emitting device including the same OCIAD1, AOX1, CRY1 HSD11B1 520/4885ABCG2 3062/4885CNR2 2608/4885
US-20160293847-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME OCIAD1, AOX1, CRY1 HSD11B1 520/4885ABCG2 3062/4885CNR2 2608/4885

“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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