SCHEMBL23917344

SCHEMBL23917344

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5c6nc7ccccn7c6ccc54)nc4ccccc34)c3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
KDM4E B2RXH2 6/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
GLA P06280 4/20 0.36
GAA P10253 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 5/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
CHEK1 O14757 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
POLB P06746 3/20 0.31
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PARP1 P09874 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
SCHEMBL21622982 0.93 ALDH1A1 (0.43) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL23917140 0.83 KDM4E (0.36) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL21622745 0.83 ADORA2A (0.47) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL21622750 0.83 KDM4E (0.39) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL23917395 0.83 ALOX5 (0.34) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL21622922 0.82 ALDH1A1 (0.40) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL21622738 0.82 ALDH1A1 (0.36) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL23917153 0.81 ALDH1A1 (0.42) ALDH1A1KDM4EL3MBTL1GLAGAA
SCHEMBL23917318 0.80 NPC1 (0.36) ALDH1A1KDM4EGLAGAASMN1; SMN2
SCHEMBL23917102 0.79 ALDH1A1 (0.42) ALDH1A1KDM4EL3MBTL1GLAGAA

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 ALDH1A1 504/4885KDM4E 2132/4885L3MBTL1 1397/4885
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM ALDH1A1 504/4885KDM4E 2132/4885L3MBTL1 1397/4885

“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.