SCHEMBL5555335

SCHEMBL5555335

CCC1(C(=O)O)CC1C(=O)c1cc(Cl)c(Cl)s1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DAO P14920 2/20 0.45
GSK3B P49841 1/20 0.42
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
CYP2D6 P10635 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL5556880 0.80 DAO (0.44) DAOGSK3BSLC6A2SLC6A4
SCHEMBL5555505 0.79 DAO (0.49) DAOGSK3BSLC6A2SLC6A4CYP2D6
SCHEMBL5555871 0.78 ALAD (0.31)
SCHEMBL5555876 0.74 GSK3B (0.41) GSK3B
SCHEMBL5555276 0.74 DAO (0.46) DAO
SCHEMBL5555874 0.73 MAPT (0.38) GSK3B
SCHEMBL5560715 0.73
SCHEMBL4039600 0.67 GRM4 (0.37) SLC6A4CYP2D6
SCHEMBL4039603 0.67 GRM4 (0.37) SLC6A4CYP2D6
SCHEMBL27534655 0.66 GSK3B (0.69) DAOGSK3BSLC6A2SLC6A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1565451-B1 HALOTHIENOYL-CYCLOPROPANE-1-CARBOXYLIC ACID DERIVATIVES NEWRON PHARM SPA (IT) 2007-05-09 EP disclosed
US-20060116329-A1 Halothenoyl-cyclopropane-1-carboxylic acid derivatives NEWRON PHARMACEUTICALS, S.P.A. (IT) 2006-06-01 US disclosed
EP-1424333-A1 Halothenoyl-cyclopropane-1-carboxylic acid derivatives Newron Pharmaceuticals S.p.A. (IT) 2004-06-02 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-20060116329-A1 Halothenoyl-cyclopropane-1-carboxylic acid derivatives KMO, HAO1, DAO DAO 3/4885GSK3B 3543/4885SLC6A2 1479/4885

“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.