SCHEMBL9306931

SCHEMBL9306931

CCc1cc2oc(C(CC(=O)O)C(O)=S)nc2c(CC)c1CC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 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
SCHEMBL9306922 0.91
SCHEMBL10890658 0.81 LMNA (0.31) LMNAPOLB
SCHEMBL10891400 0.76 PRKCZ (0.39) LMNA
SCHEMBL9305741 0.73 STING1 (0.30)
SCHEMBL9306929 0.72 SHMT2 (0.33) GAAPOLB
Methylamine SCHEMBL10867855 0.72 HDAC4 (0.43) GAALMNA
SCHEMBL9305796 0.72 RAB9A (0.38) GAA
SCHEMBL9304469 0.71 L3MBTL1 (0.31)
SCHEMBL8973089 0.71 IKBKE (0.35)
SCHEMBL9306240 0.70 DAGLA (0.42)

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
US-5347008-A Thio(cyclo) alkanepolycarboxylic acids containing heterocyclic substituents CIBA-GEIGY CORPORATION (US) 1994-09-13 US disclosed
US-5152929-A Corrosion inhibitors for water systems CIBA-GEIGY CORPORATION (US) 1992-10-06 US disclosed
US-4612049-A BENZOTHI ZOLYL THIO-, BENZIMIDAZOLYLTHIO- OR BENZOXAZOLYLTHIO-SUBSTITUTED CARBOXY ACID CIBA-GEIGY CORPORATION (US) 1986-09-16 US disclosed