SCHEMBL21742610

SCHEMBL21742610

Cc1ccccc1-c1ccccc1-c1cccc2c1c1ccccc1n2-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 3/20 0.40
TP53 P04637 1/20 0.40
PLA2G2A P14555 1/20 0.38
CYP17A1 P05093 1/20 0.38
CYP1A2 P05177 1/20 0.38
MCL1 Q07820 1/20 0.38
BAD Q92934 1/20 0.38
BRD4 O60885 1/20 0.37
PABPC1 P11940 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MAPK8 P45983 1/20 0.37
ALKBH5 Q6P6C2 1/20 0.37
FTO Q9C0B1 1/20 0.37
PGR P06401 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL19001659 0.98 KDM4E (0.53) KDM4EATML3MBTL1MAPTTP53
SCHEMBL18561901 0.90 L3MBTL1 (0.63) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL11998218 0.88 L3MBTL1 (0.65) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL21742866 0.88 KDM4E (0.49) KDM4EATML3MBTL1PLA2G2ACYP17A1
SCHEMBL23989180 0.86 KDM4E (0.50) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL21742523 0.85 KDM4E (0.46) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL21742609 0.85 L3MBTL1 (0.46) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL17229071 0.85 L3MBTL1 (0.57) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL883413 0.85 KDM4E (0.61) KDM4EATML3MBTL1MAPTPLA2G2A
SCHEMBL17877968 0.85 KDM4E (0.61) KDM4EATML3MBTL1MAPTPLA2G2A

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-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-02-20 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-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES PNMT, DDT, TYR KDM4E 3201/4885ATM 1504/4885L3MBTL1 2878/4885

“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.