SCHEMBL9449240

SCHEMBL9449240

CCOP(C)(=O)CC1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.39
MMP2 P08253 2/20 0.39
TSHR P16473 2/20 0.36
CYP1A2 P05177 1/20 0.34
ACHE P22303 2/20 0.33
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
ADRA2A P08913 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
THRB P10828 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL9152444 0.90 TSHR (0.40) MMP1MMP2TSHRACHETP53
SCHEMBL7921422 0.79 ACHE (0.35) MMP1MMP2CYP1A2ACHETDP1
SCHEMBL7915207 0.78 PPARD (0.44) MMP1MMP2TSHRCYP1A2TP53
SCHEMBL18311508 0.74 MMP1 (0.39) MMP1MMP2TSHRCYP1A2ACHE
SCHEMBL17039331 0.74 MMP1 (0.42) MMP1MMP2TSHRCYP1A2ACHE
SCHEMBL10356358 0.73 CA12 (0.38) MMP1MMP2CYP1A2ACHECA12
SCHEMBL8751304 0.73 MMP1 (0.35) MMP1MMP2TSHRCYP1A2L3MBTL1
SCHEMBL575926 0.72 MMP1 (0.42) MMP1MMP2TSHRACHETP53
SCHEMBL17034252 0.72 TP53 (0.38) MMP1MMP2TSHRCYP1A2TP53
SCHEMBL8368499 0.72 MMP1 (0.34) MMP1MMP2CYP1A2

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-5190934-A Treatment of cognitive and memory disorders CIBA-GEIGY CORPORATION (US) 1993-03-02 US disclosed