SCHEMBL10014050

SCHEMBL10014050

CC1(C)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2cc3c(cc21)c1cc(-c2ccc(-c4ccccc4)cc2)ccc1n3-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TSPO P30536 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ NR4A2 P43354 2/20 0.32
▸ PGR P06401 2/20 0.31
▸ TDP2 O95551 1/20 0.31
▸ NR3C1 P04150 1/20 0.30
▸ PTGES2 Q9H7Z7 2/20 0.30
▸ PTGES O14684 1/20 0.30
▸ AVPR1A P37288 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
SCHEMBL12647631 0.95 PDK2 (0.38) PDK2KDM4ENR4A2PGR
SCHEMBL12647527 0.94 L3MBTL1 (0.41) PDK2KDM4EATML3MBTL1TSPO
SCHEMBL10018641 0.94 PDK2 (0.36) PDK2KDM4EATML3MBTL1TSPO
SCHEMBL2609877 0.92 PDK2 (0.35) PDK2KDM4EATML3MBTL1TSPO
SCHEMBL14960778 0.92 KDM4E (0.36) PDK2KDM4EATML3MBTL1TSPO
SCHEMBL12647531 0.92 PDK2 (0.32) PDK2HDAC4PGRTDP2
SCHEMBL2609845 0.91 L3MBTL1 (0.45) PDK2KDM4EATML3MBTL1TSPO
SCHEMBL2609838 0.91 KDM4E (0.45) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL12647529 0.91 HPGD (0.36) PDK2KDM4EATML3MBTL1NR3C1
SCHEMBL17209209 0.91 PDK2 (0.38) PDK2KDM4EATML3MBTL1TSPO

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-9233923-B2 Organic compounds for organic electronic devices and terminals DUK SAN NEOLUX CO., LTD. (KR) 2016-01-12 — — US disclosed
US-9233923-B2 Organic compounds for organic electronic devices and terminals DUK SAN NEOLUX CO., LTD. (KR) 2016-01-12 — — US disclosed
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUKSAN HIGH METAL CO., LTD. (KR) 2012-01-26 — — US disclosed
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUKSAN HIGH METAL CO., LTD. (KR) 2012-01-26 — — 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-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL OR10J3, OR51E2, ESR1 PDK2 3284/4885KDM4E 648/4885ATM 3834/4885

“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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