SCHEMBL20009928

SCHEMBL20009928

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4-c4ccc(-n5c6ccccc6c6ccc7ccccc7c65)cc4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PDE6D O43924 1/20 0.32
MAPK14 Q16539 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
TSPO P30536 1/20 0.30
HDAC4 P56524 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
SCHEMBL20812986 1.00 CA12 (0.33) CA12CA1CA2CA9KDM4E
SCHEMBL24949624 0.97 CA12 (0.37) CA12CA1CA2CA9KDM4E
SCHEMBL24949622 0.97 CA12 (0.37) CA12CA1CA2CA9KDM4E
SCHEMBL24949082 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24949080 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24949036 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24949618 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24948689 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24948700 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL24949616 0.96 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4

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-10573824-B2 Compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2020-02-25 US disclosed
WO-2019143151-A1 ORGANIC LIGHT-EMITTING DIODE 주식회사 엘지화학 2019-07-25 WO disclosed
US-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-29 US disclosed
US-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-29 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 (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-20180090688-A1 COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME OR10J3, ETV6, BMI1 CA12 471/4885CA1 1221/4885CA2 2177/4885
US-10573824-B2 Compound and organic electronic element comprising same OR10J3, ETV6, BMI1 CA12 471/4885CA1 1221/4885CA2 2177/4885

“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.