SCHEMBL3126397

SCHEMBL3126397

CCC(=O)OCc1ccc(O[Si](C)(C)C(C)(C)C)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.62
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
ALDH1A1 P00352 3/20 0.39
LDHA P00338 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL3125590 0.91 DRD2 (0.64) DRD2MTNR1AMTNR1BTRPV1CA12
SCHEMBL3119217 0.89 DRD2 (0.62) DRD2TRPV1CA12CA1CA2
SCHEMBL3111579 0.88 DRD2 (0.61) DRD2TRPV1EPHX2
SCHEMBL3123728 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3123865 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3126040 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3125007 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3125726 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3123972 0.87 DRD2 (0.60) DRD2TRPV1EPHX2
SCHEMBL3121314 0.87 DRD2 (0.60) DRD2TRPV1EPHX2

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-20100256413-A1 METHOD FOR THE CHEMICAL SYNTHESIS OF CAPSINOIDS UNIVERSIDAD DE CÁDIZ (ES) 2010-10-07 US disclosed
EP-2149548-A1 METHOD FOR THE CHEMICAL SYNTHESIS OF CAPSINOIDS Universidad De Cádiz (ES) 2010-02-03 EP 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-20100256413-A1 METHOD FOR THE CHEMICAL SYNTHESIS OF CAPSINOIDS CES2, ACACB, TES DRD2 908/4885MTNR1A 4569/4885MTNR1B 4582/4885

“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.