SCHEMBL30102565

SCHEMBL30102565

CCCCC(=O)Nc1cccc(C(N)=O)c1O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CETP P11597 2/20 0.54
TSHR P16473 1/20 0.51
POLB P06746 2/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
ALDH1A1 P00352 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.47
SOAT1 P35610 2/20 0.47
HTT P42858 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
EP300 Q09472 1/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL5010196 0.88 CETP (0.63) CETPTSHRPOLBATML3MBTL1
SCHEMBL28926989 0.86 CETP (0.57) CETPTSHRPOLBATML3MBTL1
SCHEMBL6580152 0.82 CETP (0.57) CETPTSHRRXFP1KMT2ASOAT1
SCHEMBL6579983 0.82 CETP (0.57) CETPTSHRRXFP1KMT2ASOAT1
SCHEMBL9504171 0.80 CETP (0.58) CETPTSHRALDH1A1MEN1KMT2A
SCHEMBL30738545 0.79 CETP (0.53) CETPTSHRALDH1A1MEN1KMT2A
SCHEMBL29740452 0.79 MAPK1 (0.65) POLBALDH1A1MEN1KMT2AHTT
SCHEMBL1825731 0.78 CNR2 (0.49) TSHRALDH1A1MEN1KMT2AHTT
SCHEMBL14489606 0.78 ALDH1A1 (0.50) POLBALDH1A1MEN1KMT2AGAA
SCHEMBL4289827 0.78 KDM4E (0.64) POLBALDH1A1MEN1KMT2AHTT

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-115551352-A Active compound combinations and fungicide compositions comprising them 拜耳公司 2022-12-30 CN disclosed