SCHEMBL11270207

SCHEMBL11270207

COC(=O)C1C(C#N)C1(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL30585634 1.00 MEN1 (0.30) MEN1LMNAHSP90AA1MAPTHPGD
SCHEMBL30585633 1.00 MEN1 (0.30) MEN1LMNAHSP90AA1MAPTHPGD
SCHEMBL11052010 0.79 LMNA (0.49) MEN1LMNAHTTKMT2A
SCHEMBL29065423 0.78 APLNR (0.32) MAPT
SCHEMBL11140604 0.78 APLNR (0.32) MAPT
SCHEMBL13845901 0.78 APLNR (0.32) MAPT
SCHEMBL15978554 0.78 GBA1 (0.30)
SCHEMBL29246833 0.78 GBA1 (0.30)
SCHEMBL11403725 0.76
SCHEMBL11315550 0.76

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
US-4332745-A Preparation of 2-cyano-3,3-dimethyl-cyclopropane-1-carboxylic acid esters and intermediates therefor BAYER AKTIENGESELLSCHAFT (DE) 1982-06-01 US disclosed
US-4307033-A Preparation of 3,3-dimethyl-cyclopropane-1,1,2-tricarboxylic acid derivatives and intermediates therefor BAYER AKTIENGESELLSCHAFT (DE) 1981-12-22 US disclosed