SCHEMBL4574182

SCHEMBL4574182

ClCc1nc(C2(c3ccccc3)CCC2)no1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 7/20 0.45
RBP1 P09455 3/20 0.44
KMT2A Q03164 6/20 0.44
MEN1 O00255 5/20 0.44
LMNA P02545 1/20 0.43
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39

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
SCHEMBL4574107 0.97 RBP1 (0.46) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574575 0.96 RBP1 (0.46) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL8223460 0.94 RBP1 (0.40) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574917 0.87 KMT2A (0.46) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574617 0.83 KMT2A (0.62) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574830 0.83 KMT2A (0.47) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4575063 0.82 ALOX5AP (0.43) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL8212341 0.82 KMT2A (0.46) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574980 0.82 KMT2A (0.61) ALOX5APRBP1KMT2AMEN1LMNA
SCHEMBL4574604 0.81 KMT2A (0.42) ALOX5APRBP1KMT2AMEN1LMNA

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
WO-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed
WO-2008050200-A1 OXADIAZOLE COMPOUNDS AS CALCIUM CHANNEL ANTAGONISTS PFIZER PRODUCTS INC. (US) 2008-05-02 WO disclosed