SCHEMBL13557747

SCHEMBL13557747

CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3N4c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HDAC4 P56524 1/20 0.38
▸ TSPO P30536 1/20 0.34
▸ PTGER4 P35408 1/20 0.33
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ EDNRA P25101 2/20 0.31
▸ PGR P06401 1/20 0.30
▸ EDNRB P24530 1/20 0.30
▸ AKR1C4 P17516 1/20 0.30
▸ AKR1C3 P42330 1/20 0.30
▸ AKR1C2 P52895 1/20 0.30
▸ AKR1C1 Q04828 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
SCHEMBL13557757 1.00 KDM4E (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL13557752 1.00 KDM4E (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL10309962 1.00 KDM4E (0.41) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL2455750 0.99 L3MBTL1 (0.40) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL13557758 0.99 KDM4E (0.42) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL13557753 0.99 KDM4E (0.42) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL13557602 0.98 HDAC4 (0.38) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL10331684 0.98 KDM4E (0.43) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL12333522 0.98 KDM4E (0.43) KDM4EATML3MBTL1HDAC4TSPO
SCHEMBL10331702 0.98 KDM4E (0.43) KDM4EATML3MBTL1HDAC4TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120273766-A1 AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-11-01 — — US disclosed
US-20120273766-A1 AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-11-01 — — 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-20120273766-A1 AROMATIC HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME DDC, ODC1, TYR KDM4E 1308/4885ATM 1515/4885L3MBTL1 3239/4885

“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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