SCHEMBL9670600

SCHEMBL9670600

CCCCOC(=O)C1CC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
ATM Q13315 1/20 0.44
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.41
HCAR2 Q8TDS4 1/20 0.39
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
EPHX2 P34913 1/20 0.37

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
SCHEMBL294867 0.88 PPM1B (0.42) ALDH1A1HCAR2EPHX2
SCHEMBL19658928 0.85 ALDH1A1 (0.44) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL10836923 0.85 ACHE (0.32)
SCHEMBL10835432 0.83 ALDH1A1 (0.45) ALDH1A1TSHRLMNASMN1; SMN2
SCHEMBL10835159 0.83 EPHX2 (0.31) EPHX2
SCHEMBL1593042 0.83 ALDH1A1 (0.45) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL1577887 0.80 ALDH1A1 (0.42) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL294716 0.79 LMNA (0.43) ALDH1A1HPGDLMNA
SCHEMBL12497183 0.79 ALDH1A1 (0.41) ALDH1A1ATMTSHRHPGDHCAR2
SCHEMBL5314830 0.78 CHRNB2 (0.31) ALDH1A1L3MBTL1

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-0470295-A1 Process for the preparation of 2,2-dimethylcyclopropane-carboxylic acid butyl ester and its corresponding amide HÜLS AKTIENGESELLSCHAFT (DE) 1992-02-12 EP disclosed
EP-0470295-A1 Process for the preparation of 2,2-dimethylcyclopropane-carboxylic acid butyl ester and its corresponding amide HÜLS AKTIENGESELLSCHAFT (DE) 1992-02-12 EP disclosed