SCHEMBL25890252

SCHEMBL25890252

CO/N=C(/c1ccc(OC)cc1)C1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.56
NPC1 O15118 5/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
POLB P06746 1/20 0.46
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPK1 P28482 1/20 0.43
EPHX2 P34913 2/20 0.42
EPHX1 P07099 1/20 0.42
KDM2B Q8NHM5 3/20 0.42
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL25890258 1.00 RAB9A (0.56) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25890294 0.84 RAB9A (0.43) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25890263 0.83 POLB (0.42) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25890281 0.80 CCR5 (0.45) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25890295 0.78 SLC6A3 (0.40) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL17217538 0.76 RAB9A (0.40) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL15851078 0.76 RAB9A (0.40) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL25890299 0.75 F11 (0.37) RAB9ANPC1CASP3SENP8SENP7
SCHEMBL18574082 0.75 CYP1A2 (0.56) KMT2AMEN1ALDH1A1HPGD
SCHEMBL977091 0.75 RAB9A (0.52) RAB9ANPC1CASP3SENP8SENP7

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
EP-3877372-B1 ENANTIOSELECTIVE REDUCTION OF OXIME-DERIVATIVES INVOLVING IRIDIUM BASED CATALYSTS SYNGENTA CROP PROTECTION AG (CH) 2023-08-02 EP disclosed