SCHEMBL23917065

SCHEMBL23917065

c1ccc2cc(-c3nc(-n4c5ccccc5c5cc6c(cc54)nc4ccccn46)nc4ccccc34)ccc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.39
KDM4E B2RXH2 6/20 0.39
HPGD P15428 5/20 0.39
GLA P06280 4/20 0.39
GAA P10253 4/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
POLB P06746 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 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
SCHEMBL21622773 0.91 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL23917110 0.89 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL23917285 0.86 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL23917295 0.86 KDM4E (0.36) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL23917299 0.85 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL21622919 0.85 ALDH1A1 (0.40) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL21213716 0.84 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDPOLBMAPT
SCHEMBL24104511 0.84 ALDH1A1 (0.47) ALDH1A1KDM4EHPGDPOLBMAPT
SCHEMBL21622731 0.83 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL23917145 0.83 KDM4E (0.39) ALDH1A1KDM4EHPGDGLAGAA

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 2132/4885HPGD 1534/4885
US-20210320264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM ALDH1A1 504/4885KDM4E 2132/4885HPGD 1534/4885

“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.