SCHEMBL30058522

SCHEMBL30058522

OCc1cc(Cl)cnc1Cl

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDXK O00764 1/20 0.48
MAPT P10636 1/20 0.41
PLAU P00749 3/20 0.36
AR P10275 4/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.33
RECQL P46063 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NOTUM Q6P988 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
APEX1 P27695 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL10325290 1.00 PDXK (0.48) PDXKMAPTPLAUARKDM4E
SCHEMBL15289010 0.80 PDXK (0.38) PDXKMAPTPLAUKDM4EALDH1A1
SCHEMBL9263935 0.79 KMT2A (0.39) PDXKPLAUALDH1A1LMNAL3MBTL1
SCHEMBL4920949 0.78 PDXK (0.46) PDXKMAPTARKDM4EALDH1A1
SCHEMBL31456630 0.78 PDXK (0.46) PDXKMAPTARKDM4EALDH1A1
SCHEMBL1239864 0.78 KDM4E (0.46) PDXKMAPTPLAUKDM4EALDH1A1
SCHEMBL1543624 0.78 PDXK (0.46) PDXKMAPTPLAUARKDM4E
SCHEMBL31395900 0.78 PDXK (0.46) PDXKMAPTARKDM4EALDH1A1
SCHEMBL30973615 0.78 PLAU (0.38) PDXKMAPTPLAULMNARECQL
SCHEMBL15271485 0.78 PLAU (0.38) PDXKMAPTPLAULMNARECQL

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-4076460-A1 PRMT5 INHIBITORS Merck Sharp & Dohme LLC (US) 2022-10-26 EP disclosed