SCHEMBL9216232

SCHEMBL9216232

Cc1ccc(OC(=O)O)c(C(=O)NC(C)(C)C)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.39
S1PR4 O95977 1/20 0.37
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 3/20 0.35
KMT2A Q03164 1/20 0.35
GRM5 P41594 2/20 0.35
LMNA P02545 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
MAPT P10636 1/20 0.33
HPGDS O60760 1/20 0.33
SYK P43405 1/20 0.33
HCRTR1 O43613 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
SCHEMBL9214173 0.80 ALDH1A1 (0.34) RIPK1ALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL9219314 0.78 S1PR4 (0.56) S1PR4ALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL9216226 0.77 KDM4E (0.46) RIPK1ALDH1A1KDM4EGRM5GLA
SCHEMBL28593194 0.73 S1PR4 (0.40) S1PR4ALDH1A1KDM4EKMT2ALMNA
SCHEMBL9215003 0.73 MAPT (0.50) KDM4EKMT2ALMNAHPGDMAPT
SCHEMBL9413721 0.72 MEN1 (0.54) S1PR4ALDH1A1KDM4EKMT2ALMNA
SCHEMBL8308653 0.72 RIPK1 (0.34) RIPK1ALDH1A1KDM4ELMNAL3MBTL1
SCHEMBL15121730 0.71 MEN1 (0.39) S1PR4ALDH1A1KDM4EKMT2AGRM5
SCHEMBL2638389 0.71 MEN1 (0.39) S1PR4ALDH1A1KDM4EKMT2ALMNA
SCHEMBL9204335 0.70 ALDH1A1 (0.36) RIPK1ALDH1A1KDM4ELMNAL3MBTL1

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-0422456-B1 Pyridine derivatives and their use in combating unwanted plant growth BASF AG (DE) 1995-05-03 EP disclosed
EP-0422456-A2 Pyridine derivatives and their use in combating unwanted plant growth BASF Aktiengesellschaft (DE) 1991-04-17 EP disclosed