SCHEMBL7934805

SCHEMBL7934805

CC1(C)CC(=O)C(C(=O)C2CCCC2)C(=O)C1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
GAA P10253 2/20 0.51
ALDH1A1 P00352 10/20 0.50
POLB P06746 2/20 0.50
KDM4E B2RXH2 2/20 0.50
TSHR P16473 1/20 0.50
TP53 P04637 1/20 0.41
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
ATM Q13315 1/20 0.37
HIF1A Q16665 1/20 0.37
HTT P42858 2/20 0.35
TAAR1 Q96RJ0 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL9298979 0.92 MAPT (0.55) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL7925548 0.79 CES2 (0.42) MAPTSMN1; SMN2ALDH1A1TSHRKMT2A
SCHEMBL10191378 0.77 ALDH1A1 (0.46) ALDH1A1KMT2A
SCHEMBL10728337 0.76 MAPT (0.38) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL10734145 0.76 MAPT (0.45) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL10191380 0.75 ALDH1A1 (0.45) ALDH1A1TSHRKMT2A
SCHEMBL10728297 0.75 MAPT (0.37) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL10727475 0.73 MAPT (0.38) MAPTSMN1; SMN2GAAALDH1A1POLB
SCHEMBL10192796 0.73 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1KMT2AHTT
SCHEMBL11304206 0.73 ALDH1A1 (0.59) MAPTSMN1; SMN2GAAALDH1A1POLB

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
US-6291400-B1 Herbicidal compounds ZENECA LIMITED (GB) 2001-09-18 US claimed