SCHEMBL9307949

SCHEMBL9307949

Cc1cc2oc(=O)c(NC(=O)Cc3ccc(F)cc3F)c(-c3ccccc3C)c2cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.39
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
MAPK14 Q16539 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
P2RX7 Q99572 1/20 0.36
MAPK8 P45983 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL9153940 0.85 MAOB (0.43) TP53MAPTTDP1NPC1RAB9A
SCHEMBL9155117 0.84 NPC1 (0.42) NPC1RAB9A
SCHEMBL9307958 0.79 TP53 (0.39) TP53MAPTTDP1NPC1RAB9A
SCHEMBL9150777 0.76 SMN1; SMN2 (0.45) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL6940744 0.74 NPC1 (0.42) NPC1RAB9A
SCHEMBL9158313 0.73
SCHEMBL9307944 0.73 NPC1 (0.38) TP53TDP1NPC1RAB9AKMT2A
SCHEMBL8785534 0.73 TP53 (0.40) TP53MAPTKDM4EHSD17B10LMNA
SCHEMBL8786216 0.72 SMN1; SMN2 (0.45) TP53MAPTTDP1NPC1RAB9A
SCHEMBL9154464 0.72 KDR (0.48) TP53MAPTRAB9AKMT2AMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5278186-A Substituted with secondary amide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-01-11 US disclosed
EP-0514546-A1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE. TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1992-11-25 EP disclosed
WO-1991012249-A1 CHROMENE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-22 WO disclosed