SCHEMBL19544035

SCHEMBL19544035

c1ccc(-c2ccc3[nH]c4c5oc6ccc7ccccc7c6c5c5ccccc5c4c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 P11802 6/20 0.47
▸ CCND1 P24385 6/20 0.47
▸ ABCG2 Q9UNQ0 3/20 0.41
▸ PAX8 Q06710 2/20 0.41
▸ CYP1A1 P04798 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ FYN P06241 1/20 0.41
▸ MAPK3 P27361 1/20 0.41
▸ AHR P35869 1/20 0.41
▸ KIF11 P52732 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CCNB2 O95067 1/20 0.37
▸ CCNE2 O96020 1/20 0.37
▸ CDK1 P06493 1/20 0.37
▸ CCNB1 P14635 1/20 0.37
▸ CCNE1 P24864 1/20 0.37

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
SCHEMBL16482685 0.86 CDK4 (0.47) CDK4CCND1ABCG2PAX8CYP1A1
SCHEMBL18132863 0.85 MAP3K11 (0.44) CDK4CCND1KDM4EMEN1GAA
SCHEMBL19546414 0.84 CDK4 (0.48) CDK4CCND1ABCG2PAX8CYP1A1
SCHEMBL22708765 0.82 CDK5 (0.49) CDK4CCND1KDM4EMEN1GAA
SCHEMBL22708549 0.77 CDK5 (0.49) CDK4CCND1KIF11KDM4EMEN1
SCHEMBL16310389 0.77 CDK4 (0.42) CDK4CCND1KDM4EMEN1GAA
SCHEMBL23609819 0.77 CDK4 (0.73) CDK4CCND1KIF11KDM4ECCNB2
SCHEMBL17563211 0.77 CDK4 (0.73) CDK4CCND1KIF11KDM4ECCNB2
SCHEMBL22708888 0.77 CDK5 (0.35) CDK4CCND1KDM4EMEN1GAA
SCHEMBL19429492 0.77 KIF11 (0.40) CDK4CCND1ABCG2PAX8CYP1A1

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 7 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
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
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-2017188676-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2017-11-02 — — WO 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

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 CDK4 1827/4885CCND1 3607/4885ABCG2 3735/4885
US-20180102486-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, ORAI2, TRPV2 CDK4 1827/4885CCND1 3607/4885ABCG2 3735/4885
US-11008280-B2 Compound for organic electric element, organic electric element using same, and electronic device comprising same organic electronic element ORAI2, PIEZO1, ORC3 CDK4 1811/4885CCND1 2024/4885ABCG2 4409/4885
US-20190135730-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRONIC ELEMENT ORAI2, PIEZO1, ORC3 CDK4 1811/4885CCND1 2024/4885ABCG2 4409/4885

“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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