Tomentosin

Tomentosin

SCHEMBL10028477

C=C1C(=O)OC2CC(C)C(CCC(C)=O)=CCC12

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.58
▸ MAPT P10636 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ XBP1 P17861 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MDM2 Q00987 1/20 0.36
▸ PTGS2 P35354 2/20 0.35
▸ NLRP3 Q96P20 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
Tomentosin SCHEMBL29422245 1.00 KDR (0.58) KDRMAPTRAB9APKMRECQL
SCHEMBL10028473 0.82 KDR (0.51) KDRMAPTRAB9APKMRECQL
SCHEMBL2553256 0.73 KDR (1.00) KDRMAPTRAB9APKMRECQL
SCHEMBL29367155 0.73 KDR (0.52) KDRMAPTRAB9APKMRECQL
SCHEMBL16202801 0.62 LMNA (0.35) —
Carabrone SCHEMBL30046035 0.61 NLRP3 (0.40) MAPTRAB9ANPC1XBP1HTT
SCHEMBL29410309 0.60 MAPT (0.43) KDRMAPTRAB9APKMRECQL
SCHEMBL8629536 0.60 MAPT (0.43) KDRMAPTRAB9APKMRECQL
SCHEMBL9240777 0.60 MAPT (0.43) KDRMAPTRAB9APKMRECQL
SCHEMBL9242953 0.60 MAPT (0.43) KDRMAPTRAB9APKMRECQL

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-20120040916-A1 MOLECULAR INHIBITORS OF THE WNT/BETA-CATENIN PATHWAY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-02-16 — — US disclosed
US-20120040916-A1 MOLECULAR INHIBITORS OF THE WNT/BETA-CATENIN PATHWAY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-02-16 — — 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-20120040916-A1 MOLECULAR INHIBITORS OF THE WNT/BETA-CATENIN PATHWAY WNT1, CTNNB1, WNT3A KDR 4401/4885MAPT 1720/4885RAB9A 1578/4885

“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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