SCHEMBL4574980

SCHEMBL4574980

Cc1ccc(C2(c3noc(CCl)n3)CCCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.61
MEN1 O00255 5/20 0.61
LMNA P02545 2/20 0.59
RBP1 P09455 3/20 0.57
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
HTT P42858 1/20 0.54
ALOX5AP P20292 4/20 0.42
HSD11B1 P28845 2/20 0.37
HSD11B2 P80365 2/20 0.37

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
SCHEMBL4574617 0.99 KMT2A (0.62) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4575272 0.93 KMT2A (0.55) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL8212341 0.86 KMT2A (0.46) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574575 0.86 RBP1 (0.46) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574830 0.85 KMT2A (0.47) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574107 0.85 RBP1 (0.46) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574917 0.83 KMT2A (0.46) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574182 0.82 ALOX5AP (0.45) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4574604 0.80 KMT2A (0.42) KMT2AMEN1LMNARBP1ALDH1A1
SCHEMBL4575063 0.79 ALOX5AP (0.43) KMT2AMEN1LMNARBP1ALDH1A1

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