SCHEMBL24649901

SCHEMBL24649901

CC1(C)c2cc3c(cc2-c2c1cc(-c1ccc(-c4cccc5ccccc45)cc1)c1c2oc2ccccc21)C(C)(C)c1cc(-c2ccc(-c4cccc5ccccc45)cc2)c2c(oc4ccccc42)c1-3

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.36
▸ ENPP3 O14638 1/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ CA12 O43570 3/20 0.35
▸ CA1 P00915 3/20 0.35
▸ CA2 P00918 3/20 0.35
▸ CA9 Q16790 3/20 0.35
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ CHRNA1 P02708 1/20 0.32
▸ CHRNG P07510 1/20 0.32
▸ CHRNB1 P11230 1/20 0.32
▸ CHRNB2 P17787 1/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ CHRND Q07001 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
SCHEMBL20205312 0.96 ENPP3 (0.34) ALOX5ENPP3ENPP1CA12CA1
SCHEMBL20205376 0.92 ALOX5 (0.36) ALOX5ENPP3ENPP1CA12CA1
SCHEMBL23351763 0.92 MAOA (0.36) ALOX5CYP2C19KDM4EALDH1A1HSD17B10
SCHEMBL20205375 0.91 ENPP3 (0.36) ALOX5ENPP3ENPP1CA12CA1
SCHEMBL20205449 0.91 ALOX5 (0.36) ALOX5KDM4EALDH1A1HSD17B10MAOA
SCHEMBL20210044 0.88 ENPP3 (0.32) ALOX5ENPP3ENPP1CHRNA1CHRNG
SCHEMBL24649650 0.88 ALOX5 (0.33) ALOX5ENPP3ENPP1CA12CA1
SCHEMBL20205313 0.88 CDC14B (0.38) ALOX5CA12CA1CA2CA9
SCHEMBL20205307 0.88 CDC14B (0.39) CA12CA1CA2CA9HDAC6
SCHEMBL20205712 0.87 MAOA (0.34) ALOX5KDM4EALDH1A1HSD17B10MAOA

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-11453680-B2 Bisbenzofuran-fused indeno[1,2-B]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) MERCK PATENT GMBH (DE) 2022-09-27 — — 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-11453680-B2 Bisbenzofuran-fused indeno[1,2-B]fluorene derivatives and related compounds as materials for organic electroluminescent devices (OLED) OCIAD2, OCIAD1, JUND ALOX5 354/4885ENPP3 2950/4885ENPP1 2590/4885

“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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