SCHEMBL13699552

SCHEMBL13699552

CC1(C)OB(c2ccc(-c3cccs3)cc2)OC1(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 13/20 1.00
LPL P06858 12/20 1.00
LTA4H P09960 1/20 0.43
KCNH2 Q12809 1/20 0.42
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
CA12 O43570 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
CYP2E1 P05181 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2B6 P20813 1/20 0.40

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
SCHEMBL28389622 0.80 LIPG (0.88) LIPGLPLCA1CA2CA9
SCHEMBL14060391 0.79 LIPG (0.65) LIPGLPLKCNH2CYP2E1CYP3A4
SCHEMBL1534963 0.78 LPL (0.64) LIPGLPLLTA4HKCNH2CYP2E1
SCHEMBL24608995 0.78 LIPG (0.83) LIPGLPLCA1CA2CA9
SCHEMBL2707320 0.78 LIPG (0.83) LIPGLPLCA1CA2CA9
SCHEMBL24364221 0.75 LIPG (0.60) LIPGLPLCA1CA2CA9
SCHEMBL228212 0.75 LPL (0.71) LIPGLPLCA1CA2CA9
SCHEMBL10021061 0.74 LIPG (1.00) LIPGLPLCA1CA2CA9
SCHEMBL476870 0.74 LIPG (1.00) LIPGLPLCA1CA2CA9
SCHEMBL18270366 0.74 LIPG (1.00) LIPGLPLCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11008280-B2 Compound for organic electric element, organic electric element using same, and electronic device comprising same organic electronic element DUK SAN NEOLUX CO., LTD. (KR) 2021-05-18 US disclosed
EP-3326998-B1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO LTD (KR) 2020-12-02 EP disclosed
US-10797247-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2020-10-06 US disclosed
US-20190135730-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRONIC ELEMENT DUK SAN NEOLUX CO., LTD. (KR) 2019-05-09 US disclosed
EP-3326998-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME, AND ELECTRONIC DEVICE THEREOF Duk San Neolux Co., Ltd. (KR) 2018-05-30 EP disclosed
US-20180102486-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-04-12 US disclosed
US-20180102486-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-04-12 US disclosed
WO-2017188655-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRONIC ELEMENT 덕산네오룩스 주식회사 2017-11-02 WO disclosed
WO-2017188676-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-11-02 WO disclosed
EP-2098520-B1 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INT (FR) 2013-07-03 EP disclosed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 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 (4 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-10797247-B2 Compound for organic electric element, organic electric element comprising the same and electronic device thereof PIEZO1, ORAI2, TRPV2 LIPG 2217/4885LPL 2851/4885LTA4H 2132/4885
US-20180102486-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, ORAI2, TRPV2 LIPG 2217/4885LPL 2851/4885LTA4H 2132/4885
US-11008280-B2 Compound for organic electric element, organic electric element using same, and electronic device comprising same organic electronic element ORAI2, PIEZO1, ORC3 LIPG 3016/4885LPL 3122/4885LTA4H 1700/4885
US-20190135730-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRONIC ELEMENT ORAI2, PIEZO1, ORC3 LIPG 3016/4885LPL 3122/4885LTA4H 1700/4885

“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.