SCHEMBL6904766

SCHEMBL6904766

CCC(CCC1CC(C)(C)NC(C)(C)C1)(C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.39
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL8979624 0.75 GAA (0.38) GAATSHRHTTPOLB
SCHEMBL6904761 0.73 GAA (0.47) GAAHTTKDM4EKMT2APOLB
SCHEMBL910496 0.73 HTT (0.33) GAAHTTKDM4EKMT2APOLB
SCHEMBL7555204 0.73 GAA (0.38) GAATSHRHTTKDM4EKMT2A
Bicarbonate SCHEMBL2909433 0.73 TSHR (0.40) GAATSHRHTTKDM4EKMT2A
SCHEMBL6701258 0.70 TSHR (0.39) GAATSHRKDM4EKMT2A
SCHEMBL2547053 0.69 GAA (0.46) GAATSHRHTTKDM4EKMT2A
SCHEMBL16749055 0.68 GAA (0.43) GAATSHRKDM4E
SCHEMBL10430410 0.68 TSHR (0.36) GAATSHRKDM4E
SCHEMBL11865149 0.68 TSHR (0.55) GAATSHRHTTKDM4EKMT2A

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
EP-1084183-B1 GRANULAR FORM OF A MIXTURE OF A NICKEL-QUENCHER AND A BENZOPHENONE AND PROCESS FOR ITS PREPARATION GREAT LAKES CHEMICAL EUROP (CH) 2004-06-16 EP disclosed
EP-1110999-A2 Stabilizing mixtures for organic polymers Great Lakes Chemical (Europe) GmbH (CH) 2001-06-27 EP disclosed