SCHEMBL31455496

SCHEMBL31455496

COC(=O)C1C(C)(C)CC(C=O)CC1(C)C

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTT P42858 1/20 0.32
POLB P06746 1/20 0.31
MMP2 P08253 1/20 0.31
ANPEP P15144 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL17536733 0.79 ATM (0.34) GAAMAPTNPSR1HTTPOLB
SCHEMBL17536787 0.79 ATM (0.34) GAAMAPTNPSR1HTTPOLB
SCHEMBL17536732 0.79 ATM (0.34) GAAMAPTNPSR1HTTPOLB
SCHEMBL30111020 0.74 CYP2C19 (0.37) POLB
SCHEMBL31455369 0.72 APLNR (0.37) GAAMAPTNPSR1HTTKMT2A
Formic Acid SCHEMBL29200818 0.71 MAPT (0.38) GAAMAPTNPSR1KMT2A
SCHEMBL31299409 0.69
SCHEMBL294509 0.69
SCHEMBL13739914 0.68 CHRNB2 (0.50) MMP2ANPEP
SCHEMBL13739611 0.68 CHRNB2 (0.50) MMP2ANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed