SCHEMBL23076197

SCHEMBL23076197

O=c1nc(-c2ccccc2)nc2cc(-c3ccccc3)cc(-c3ccccc3)n12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ GLO1 Q04760 4/20 0.42
▸ HSP90AA1 P07900 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ KDR P35968 1/20 0.36
▸ ADK P55263 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ADORA2A P29274 2/20 0.34
▸ ADORA1 P30542 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADORA2B P29275 1/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ PDE10A Q9Y233 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
SCHEMBL23076209 0.90 L3MBTL1 (0.40) L3MBTL1GLO1HSP90AA1ALDH1A1KDR
SCHEMBL23076198 0.78 HPGD (0.33) L3MBTL1GLO1HSP90AA1ALDH1A1TSHR
SCHEMBL23076202 0.77 PLA2G2A (0.39) L3MBTL1ALDH1A1ADORA3
SCHEMBL23075955 0.71 RET (0.43) ALDH1A1KDR
SCHEMBL23076022 0.69 KDM4E (0.57) L3MBTL1ALDH1A1TSHRPOLB
SCHEMBL23075992 0.68 RET (0.46) ALDH1A1KDR
SCHEMBL23075995 0.68 POLB (0.36) L3MBTL1ADKTSHRADORA2AADORA1
SCHEMBL24663212 0.67 HSD17B10 (0.54) HSP90AA1ALDH1A1POLB
SCHEMBL21390299 0.65 MEN1 (0.59) L3MBTL1ALDH1A1ADORA2AADORA1POLB
SCHEMBL14426033 0.65 MEN1 (0.59) L3MBTL1ALDH1A1ADORA2AADORA1POLB

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-20220310932-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-09-29 — — US disclosed
WO-2021043703-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-03-11 — — 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 (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-20220310932-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES OR10J3, EPCAM, L1CAM L3MBTL1 1415/4885GLO1 1153/4885HSP90AA1 4490/4885

“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.

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