SCHEMBL27460976

SCHEMBL27460976

CCC(C)C(C)(NC(C)=O)C(=O)O.COc1ccccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
POLB P06746 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
ALDH1A1 P00352 6/20 0.38
HPGD P15428 1/20 0.38
FABP4 P15090 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
CXCL8 P10145 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CNR1 P21554 1/20 0.36

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
SCHEMBL27384190 0.91 TAS1R3 (0.43) MEN1KMT2AMAPTLMNAMTNR1A
SCHEMBL27407410 0.87 ALDH1A1 (0.42) MEN1KMT2AMTNR1AMTNR1BALDH1A1
SCHEMBL4435090 0.81 LPAR1 (0.41) LMNAPOLBALDH1A1HPGDSMN1; SMN2
SCHEMBL27460977 0.81 HPGD (0.42) MEN1KMT2AMAPTMTNR1AMTNR1B
SCHEMBL6474679 0.80 L3MBTL1 (0.42) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL27403677 0.79 FABP4 (0.43) MEN1KMT2AMAPTLMNAMTNR1A
SCHEMBL27385195 0.79 MAPT (0.41) MEN1KMT2AMAPTLMNAMTNR1A
SCHEMBL27401982 0.78 ALDH1A1 (0.42) MEN1KMT2AMAPTLMNAMTNR1A
SCHEMBL27420112 0.78 TAS1R3 (0.35) KMT2AMAPTLMNAMTNR1AMTNR1B
SCHEMBL27387187 0.78 TAS1R3 (0.43) MAPTPOLBALDH1A1SMN1; SMN2KDM4E

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
CN-1080258-C 1-H-3-aryl-pyrrolidine-2, 4-dione derivatives as pesticides BAYER AG (DE) 2002-03-06 CN disclosed