SCHEMBL17848809

SCHEMBL17848809

O=C(O)C1CSCC1C(=O)OC(=O)C1CSCC1C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 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
SCHEMBL15055464 0.84 GABRR1 (0.43) GABRR1
SCHEMBL70312 0.84 GABRR1 (0.43) GABRR1
SCHEMBL8972064 0.82 PPM1B (0.37)
SCHEMBL8969007 0.77 POLB (0.33)
SCHEMBL8970065 0.77 GRM2 (0.36)
SCHEMBL8970200 0.77 PPM1B (0.42)
SCHEMBL8970499 0.74 PPM1B (0.45)
SCHEMBL4478750 0.74 GABRR1 (0.46) GABRR1
SCHEMBL5070654 0.74 GABRR1 (0.46) GABRR1
SCHEMBL168962 0.74 GABRR1 (0.46) GABRR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210070771-A1 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES VERRICA PHARMACEUTICALS, INC. (US) 2021-03-11 US disclosed
US-10745413-B2 Commercially viable synthesis of cantharidin and bioactive cantharidin derivatives VERRICA PHARMACEUTICALS, INC. (US) 2020-08-18 US disclosed
US-20190002474-A1 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES VERRICA PHARMACEUTICALS INC. 2019-01-03 US disclosed
EP-3233865-A2 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES Verrica Pharmaceuticals, Inc. (US) 2017-10-25 EP disclosed
WO-2016100732-A2 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES VERRICA PHARMACEUTICALS, INC. (US) 2016-06-23 WO 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 (3 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-20210070771-A1 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES TYR, CHIA, NISCH GABRR1 4122/4885
US-10745413-B2 Commercially viable synthesis of cantharidin and bioactive cantharidin derivatives TYR, CHIA, NISCH GABRR1 4122/4885
US-20190002474-A1 COMMERCIALLY VIABLE SYNTHESIS OF CANTHARIDIN AND BIOACTIVE CANTHARIDIN DERIVATIVES TYR, CHIA, NISCH GABRR1 4122/4885

“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.