SCHEMBL23917140

SCHEMBL23917140

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c5nc6ccccn6c5ccc43)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.36
ALDH1A1 P00352 6/20 0.36
GAA P10253 6/20 0.36
NPC1 O15118 5/20 0.36
GLA P06280 5/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PARP1 P09874 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HSD17B10 Q99714 3/20 0.34
TP53 P04637 1/20 0.34
MAPK10 P53779 1/20 0.34
HPGD P15428 3/20 0.33
MAPT P10636 2/20 0.33

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
SCHEMBL21622982 0.86 ALDH1A1 (0.43) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917310 0.85 KDM4E (0.31) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917405 0.85 KDM4E (0.34) KDM4EALDH1A1GAANPC1GLA
SCHEMBL21622878 0.84 KDM4E (0.36) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917344 0.83 ALDH1A1 (0.37) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917077 0.83 KDM4E (0.40) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917305 0.83 KDM4E (0.46) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917120 0.83 NPC1 (0.36) KDM4EALDH1A1GAANPC1GLA
SCHEMBL23917318 0.82 NPC1 (0.36) KDM4EALDH1A1GAANPC1GLA
SCHEMBL17189843 0.82 KDM4E (0.39) KDM4EALDH1A1GAANPC1GLA

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-11581497-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2023-02-14 US disclosed
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-10-14 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-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.