SCHEMBL6989364

SCHEMBL6989364

CC(=O)NC(Oc1cccc(NC(N)=O)c1)(C(=O)Nc1cccc(-c2noc(C)n2)c1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.51
LMNA P02545 5/20 0.51
NPC1 O15118 2/20 0.51
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GAA P10253 1/20 0.51
MAPK1 P28482 1/20 0.51
RAB9A P51151 1/20 0.51
MAPT P10636 7/20 0.45
POLB P06746 2/20 0.45
HAVCR2 Q8TDQ0 6/20 0.43
ALDH1A1 P00352 3/20 0.40
TSHR P16473 3/20 0.40
HSD17B10 Q99714 1/20 0.40
USP2 O75604 1/20 0.40
CA2 P00918 1/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL6989368 0.79 TP53 (0.46) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL13273862 0.79 MAPT (0.63) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL6809066 0.76 TP53 (0.52) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL6804740 0.75 HAVCR2 (0.64) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL6807561 0.72 TP53 (0.63) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL7056553 0.71 TP53 (0.66) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL6298662 0.71 L3MBTL1 (0.52) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL6809084 0.70 SMN1; SMN2 (0.66) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL8268112 0.68 MAPT (0.60) TP53LMNANPC1HTTSMN1; SMN2
SCHEMBL16481833 0.66 L3MBTL1 (0.64) TP53LMNANPC1HTTSMN1; SMN2

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
EP-1370522-A1 PHENYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOEMBOLIC DISORDERS OR TUMOURS MERCK PATENT GmbH (DE) 2003-12-17 EP disclosed
WO-2002070471-A1 PHENYL DERIVATIVES AND THEIR USE IN THE TREATMENT OF THROMBOEMBOLIC DISORDERS OR TUMOURS MERCK PATENT GMBH (DE) 2002-09-12 WO disclosed