SCHEMBL527900

SCHEMBL527900

CCS(=O)(=O)N(Cc1ccc(NC(=O)c2cccc(C)c2)cc1)c1ccc(C)c(C)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
LMNA P02545 3/20 0.60
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
TP53 P04637 3/20 0.53
FFAR1 O14842 1/20 0.53
GLA P06280 1/20 0.53
NPSR1 Q6W5P4 1/20 0.50
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KCNK3 O14649 2/20 0.47
KCNH2 Q12809 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
POLB P06746 1/20 0.46
GPR17 Q13304 1/20 0.46
NT5E P21589 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL529349 0.91 MAPT (0.61) MAPTLMNAMEN1KMT2ATP53
SCHEMBL528087 0.91 KMT2A (0.55) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL528010 0.90 SMN1; SMN2 (0.52) MAPTLMNAMEN1KMT2ATP53
SCHEMBL528111 0.90 MAPT (0.48) MAPTLMNAMEN1KMT2ATP53
SCHEMBL529259 0.89 MAPT (0.55) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL529579 0.88 MAPT (0.61) MAPTLMNAMEN1KMT2ATP53
SCHEMBL529437 0.88 MAPT (0.58) MAPTLMNAMEN1KMT2ATP53
SCHEMBL528642 0.88 LMNA (0.48) MAPTLMNANPSR1POLBGPR17
SCHEMBL528683 0.87 MAPT (0.77) MAPTLMNAMEN1KMT2ATP53
SCHEMBL528856 0.85 MAPT (0.49) MAPTLMNAMEN1KMT2ANPSR1

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
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed