SCHEMBL24965769

SCHEMBL24965769

c1ccc(-c2ccc3ccccc3c2)c(-c2ccc(N(c3ccc4c(c3)oc3ccccc34)c3ccccc3-c3ccc4oc5ccccc5c4c3)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.34
▸ HSP90AB1 P08238 1/20 0.34
▸ AHR P35869 3/20 0.33
▸ MAPT P10636 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ HPGD P15428 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ CASP3 P42574 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ HCRTR1 O43613 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32
▸ GSTP1 P09211 1/20 0.32

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
SCHEMBL24964042 0.96 CASP3 (0.34) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24964043 0.96 CASP3 (0.34) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24962992 0.95 HCRTR1 (0.36) AHRMAPTALDH1A1HPGDKDM4E
SCHEMBL24965438 0.94 HSP90AA1 (0.35) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24965802 0.94 HSP90AA1 (0.35) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24965803 0.94 ALOX5 (0.34) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24965804 0.93 HSP90AA1 (0.34) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL23231765 0.92 HCRTR1 (0.37) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL24965697 0.92 PLA2G2A (0.36) HSP90AA1HSP90AB1AHRMAPTALDH1A1
SCHEMBL23233240 0.92 PLA2G2A (0.36) HSP90AA1HSP90AB1AHRMAPTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230026162-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-26 — — 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 (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-20230026162-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, LEF1, MLX HSP90AA1 4350/4885HSP90AB1 4486/4885AHR 2398/4885

“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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