SCHEMBL21622883

SCHEMBL21622883

c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5cc6c(cc54)nc4ccccn46)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.47
ALDH1A1 P00352 11/20 0.47
GAA P10253 9/20 0.47
GLA P06280 8/20 0.47
HPGD P15428 6/20 0.47
POLB P06746 2/20 0.47
NPC1 O15118 2/20 0.47
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HSD17B10 Q99714 3/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
PDE10A Q9Y233 2/20 0.38
CASP1 P29466 2/20 0.34
CASP7 P55210 2/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL23917137 0.92 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL21622976 0.90 KDM4E (0.51) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL25535404 0.88 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL21622757 0.87 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL23917357 0.86 KDM4E (0.48) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL21622715 0.86 KDM4E (0.39) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL23917068 0.84 KDM4E (0.46) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL21622689 0.84 KDM4E (0.39) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL23917075 0.83 KDM4E (0.45) KDM4EALDH1A1GAAGLAHPGD
SCHEMBL23917110 0.83 ALDH1A1 (0.39) KDM4EALDH1A1GAAGLAHPGD

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-11581497-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-02-14 US disclosed
EP-3820966-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-06-08 EP disclosed
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-10-14 US disclosed
WO-2020011686-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-01-16 WO 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-11581497-B2 Materials for organic electroluminescent devices OR10J3, EPCAM, L1CAM KDM4E 2132/4885ALDH1A1 504/4885GAA 2390/4885
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM KDM4E 2132/4885ALDH1A1 504/4885GAA 2390/4885

“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.