SCHEMBL27250604

SCHEMBL27250604

COCCOCC(COc1cccc(OCC(COCCOC)OCC(COc2ccccc2)OCC(COc2ccccc2)OCC(COc2ccccc2)OCC(COc2ccccc2)OCC(COc2ccccc2)OCC(O)COCCC[Si](OC)(OC)OC)c1)OCC(COc1ccccc1)OCC(COc1ccccc1)OCC(COc1ccccc1)OCC(COc1ccccc1)OCC(COc1ccccc1)OCC(O)COCCC[Si](OC)(OC)OC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ HSP90AB1 P08238 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ ALOX5 P09917 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33

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
SCHEMBL12978498 0.82 LMNA (0.45) TSHRKDM4EHIF1AMAPTLMNA
SCHEMBL27250603 0.76 PLA2G4B (0.42) TSHRLMNAPPARG
SCHEMBL12222347 0.75 LMNA (0.43) TSHRMAPK1KDM4EHIF1AMAPT
SCHEMBL12222349 0.74 ADRB2 (0.46) KDM4EMAPTLMNAALDH1A1CYP3A4
SCHEMBL12222360 0.74 LMNA (0.53) TSHRMAPK1KDM4EHIF1AMAPT
SCHEMBL12172005 0.73 LMNA (0.43) LMNA
SCHEMBL14904490 0.72 LMNA (0.50) TSHRKDM4EHIF1AMAPTLMNA
SCHEMBL27250609 0.71 MAPK1 (0.43) TSHRMAPK1MAPTLMNASMN1; SMN2
SCHEMBL14904491 0.71 PLA2G4B (0.53) TSHRMAPK1KDM4EHIF1A
SCHEMBL2720404 0.70 MAPK1 (0.50) TSHRMAPK1KDM4EHIF1AHSP90AB1

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-20240209160-A1 POLYMERIC DISPERSANTS FROM PHENYL GLYCIDYL ETHER STEPAN COMPANY 2024-06-27 — — 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-20240209160-A1 POLYMERIC DISPERSANTS FROM PHENYL GLYCIDYL ETHER TYR, PAOX, NAPEPLD TSHR 2537/4885MAPK1 3009/4885KDM4E 3812/4885

“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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