SCHEMBL17345237

SCHEMBL17345237

CCOCC(O)COc1ccc(C2(c3ccc(OCC4CO4)c(CC(O)COCC)c3)c3ccccc3-c3ccccc32)cc1CC1CO1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31

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
SCHEMBL17051361 0.90
SCHEMBL17345231 0.83 ALDH1A1 (0.37) ALDH1A1GLANPC1TP53TSHR
SCHEMBL17350000 0.83 ALDH1A1 (0.37) ALDH1A1GLANPC1TP53TSHR
SCHEMBL17051362 0.83 ALDH1A1 (0.43) ALDH1A1GLATP53TSHRSMN1; SMN2
SCHEMBL17345239 0.80 MEN1 (0.37) ALDH1A1GLANPC1TP53TSHR
SCHEMBL22493976 0.79 ESR1 (0.43) ALDH1A1GLASMN1; SMN2ESR1ESR2
SCHEMBL15356214 0.78 ALDH1A1 (0.45) ALDH1A1GLATP53TSHRSMN1; SMN2
SCHEMBL19157866 0.76
SCHEMBL19227278 0.75 ALDH1A1 (0.36) ALDH1A1GLATP53TSHRSMN1; SMN2
SCHEMBL19227286 0.75 ALDH1A1 (0.36) ALDH1A1GLATP53TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9732182-B2 Epoxy compound having alkoxysilyl group, method of preparing the same, composition and cured product comprising the same, and use thereof KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2017-08-15 US disclosed
US-9732182-B2 Epoxy compound having alkoxysilyl group, method of preparing the same, composition and cured product comprising the same, and use thereof KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2017-08-15 US disclosed
US-20150361211-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD OF PREPARING THE SAME, COMPOSITION AND CURED PRODUCT COMPRISING THE SAME, AND USE THEREOF KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-12-17 US disclosed
US-20150361211-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD OF PREPARING THE SAME, COMPOSITION AND CURED PRODUCT COMPRISING THE SAME, AND USE THEREOF KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2015-12-17 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-20150361211-A1 EPOXY COMPOUND HAVING ALKOXYSILYL GROUP, METHOD OF PREPARING THE SAME, COMPOSITION AND CURED PRODUCT COMPRISING THE SAME, AND USE THEREOF ESD, PFAS, SCD5 ALDH1A1 514/4885GLA 1424/4885NPC1 3136/4885

“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.