SCHEMBL22859290

SCHEMBL22859290

CCOC(=O)c1ccc2c(c1)C(C)(C)c1cc(-c3cc(-c4ccc5c(c4)C(C)(C)c4cc(C(=O)OCC)ccc4-5)c4ccc5c(-c6ccc7c(c6)C(C)(C)c6cc(C(=O)OCC)ccc6-7)cc(-c6ccc7c(c6)C(C)(C)c6cc(C(=O)OCC)ccc6-7)c6ccc3c4c65)ccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.47
▸ CA12 O43570 2/20 0.43
▸ CA1 P00915 2/20 0.43
▸ CA2 P00918 2/20 0.43
▸ CA7 P43166 2/20 0.43
▸ CA9 Q16790 2/20 0.43
▸ CA14 Q9ULX7 2/20 0.43
▸ IMPDH2 P12268 1/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ HCRTR1 O43613 2/20 0.40
▸ HSD17B2 P37059 1/20 0.39
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ RARA P10276 1/20 0.39
▸ RARB P10826 1/20 0.39
▸ RARG P13631 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39

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
SCHEMBL25634095 0.94 PDK2 (0.43) PDK2CA12CA1CA2CA7
SCHEMBL30421629 0.82 ALK (0.44) PDK2RARARARBRARG
SCHEMBL22859400 0.82 ALK (0.44) PDK2RARARARBRARG
SCHEMBL25199664 0.78 CA12 (0.48) PDK2CA12CA1CA2CA7
SCHEMBL10045392 0.76 TSHR (0.54) PDK2RAB9AALDH1A1NPC1MAPK1
SCHEMBL22859111 0.74 MAPT (0.48) CA12CA1CA2CA7CA9
SCHEMBL30422168 0.74 MAPT (0.48) CA12CA1CA2CA7CA9
SCHEMBL12154187 0.73 RARA (0.52) PDK2CA12CA1CA2CA7
SCHEMBL22859291 0.72 CA12 (0.42) PDK2CA12CA1CA2CA7
SCHEMBL19935930 0.72 ALDH1A1 (0.40) PDK2CA12CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230194165-A1 RADIOFREQUENCY HEATING OF WOOD USING A THREE-ELECTRODE SYSTEM HAVING A WINGED CENTRAL ELECTRODE RF KILN TECH LIMITED (CA) 2023-06-22 — — US disclosed
US-11666637-B2 Insulin-loaded metal-organic frameworks NORTHWESTERN UNIVERSITY (US) 2023-06-06 — — US disclosed
US-20210000924-A1 INSULIN-LOADED METAL-ORGANIC FRAMEWORKS NORTHWESTERN UNIVERSITY 2021-01-07 — — 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-11666637-B2 Insulin-loaded metal-organic frameworks IAPP, IGFBP4, IGFBP1 PDK2 1431/4885CA12 800/4885CA1 1198/4885
US-20210000924-A1 INSULIN-LOADED METAL-ORGANIC FRAMEWORKS IAPP, IGFBP4, IGFBP1 PDK2 1431/4885CA12 800/4885CA1 1198/4885

“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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