SCHEMBL12267675

SCHEMBL12267675

CC(C)(C)c1ccc(B2Oc3cc4c5cc6c(cc5c5cc7c(cc5c4cc3O2)OB(c2ccc(C(C)(C)C)cc2)O7)OB(c2ccc(C(C)(C)C)cc2)O6)cc1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.37
▸ LMNA P02545 1/20 0.35
▸ TYR P14679 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ KIF11 P52732 5/20 0.31
▸ CA12 O43570 1/20 0.30
▸ CA9 Q16790 1/20 0.30

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
SCHEMBL12267662 0.81 — —
SCHEMBL12267654 0.74 TSHR (0.46) TSHRLMNATYRALDH1A1HPGD
SCHEMBL12267625 0.74 TSHR (0.46) TSHRLMNATYRALDH1A1HPGD
SCHEMBL10002179 0.74 — —
SCHEMBL13567247 0.69 TSHR (0.41) TSHRLMNATYRALDH1A1HPGD
SCHEMBL10002186 0.69 — —
SCHEMBL417710 0.68 LPL (0.55) TSHRCA12CA9
SCHEMBL24168797 0.68 CSNK2A2 (0.36) LMNAALDH1A1
SCHEMBL424728 0.65 TSHR (0.73) TSHRLMNATYRALDH1A1HPGD
SCHEMBL12524043 0.64 LIPG (0.65) KIF11CA12CA9

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-20140037944-A1 COVALENT ORGANIC FRAMEWORK FILMS, AND METHODS OF MAKING AND USES OF SAME CORNELL UNIVERSITY (US) 2014-02-06 — — US disclosed
US-20110230678-A1 ORGANIC FRAMEWORK INSILICOTECH CO., LTD (KR) 2011-09-22 — — 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-20110230678-A1 ORGANIC FRAMEWORK MCM4, DBF4, ORC3 TSHR 4060/4885LMNA 2201/4885TYR 791/4885

“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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