SCHEMBL21139950

SCHEMBL21139950

C=Cc1c(/C=C\C)c2ccc3c4ccccc4n(-c4ccccc4)c3c2n1-c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
AKR1C4 P17516 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
TSPO P30536 1/20 0.31
HDAC4 P56524 1/20 0.31
PTGER4 P35408 1/20 0.31

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
SCHEMBL22007507 0.93 KDM4E (0.39) KDM4EATML3MBTL1
SCHEMBL19867970 0.93 KDM4E (0.38) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL24988448 0.92 KDM4E (0.36) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL23838475 0.90 KDM4E (0.41) KDM4EATML3MBTL1
SCHEMBL19660122 0.90 KDM4E (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL21117110 0.89 KDM4E (0.42) KDM4EATML3MBTL1
SCHEMBL24277812 0.89 KDM4E (0.33) KDM4EATML3MBTL1
SCHEMBL22912412 0.88 KDM4E (0.38) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL21965264 0.88 KDM4E (0.43) KDM4EATML3MBTL1AKR1C4AKR1C3
SCHEMBL21566363 0.87 KDM4E (0.37) KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190181351-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC ELEMENT, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2019-06-13 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-20190181351-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC ELEMENT, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE OCIAD2, OCIAD1, OR10J3 KDM4E 4011/4885ATM 3531/4885L3MBTL1 4595/4885

“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.