SCHEMBL1826299

SCHEMBL1826299

CSCCC(N)C(=O)NCc1ccc2c(Sc3ccccc3)c(OC(N)=O)[nH]c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.42
MAPT P10636 3/20 0.42
CTSC P53634 2/20 0.42
POLB P06746 1/20 0.40
FNTA P49354 2/20 0.39
FNTB P49356 2/20 0.39
PGGT1B P53609 1/20 0.39
RXFP1 Q9HBX9 1/20 0.37
EGFR P00533 2/20 0.36
SRC P12931 1/20 0.36
TUBB4A P04350 3/20 0.36
TUBB P07437 3/20 0.36
TUBA3C P0DPH7 3/20 0.36
TUBA1B P68363 3/20 0.36
TUBA4A P68366 3/20 0.36
TUBB4B P68371 3/20 0.36
TUBB3 Q13509 3/20 0.36
TUBB2A Q13885 3/20 0.36
TUBB8 Q3ZCM7 3/20 0.36
TUBA3E Q6PEY2 3/20 0.36

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
SCHEMBL1825821 0.88 MMP2 (0.41) TP53MAPTPOLBRXFP1EGFR
SCHEMBL1823690 0.88 EGFR (0.45) TP53MAPTPOLBRXFP1EGFR
SCHEMBL1825415 0.88 TP53 (0.48) TP53MAPTPOLBRXFP1TUBB4A
SCHEMBL1615784 0.87 TP53 (0.48) TP53MAPTCTSCPOLBFNTA
SCHEMBL1825496 0.84 TP53 (0.45) TP53MAPTPOLBRXFP1TUBB4A
SCHEMBL1826407 0.82 TP53 (0.46) TP53MAPTPOLBRXFP1TUBB4A
SCHEMBL1826130 0.81 TP53 (0.44) TP53MAPTPOLBRXFP1TUBB4A
SCHEMBL1824783 0.79 MAPT (0.44) TP53MAPTPOLBTUBB4ATUBB
SCHEMBL1826315 0.78 TP53 (0.42) TP53MAPTPOLBRXFP1TUBB4A
SCHEMBL1822442 0.78 TP53 (0.42) TP53MAPTPOLBRXFP1TUBB4A

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
EP-1794122-B1 3-SUBSTITUTED-5- AND 6-AMINOALKYL INDOLE-2-CARBOXYLIC ACID AMIDES AND RELATED ANALOGS AS INHIBITORS OF CASEIN KINASE I AVENTIS PHARMA INC (US) 2011-05-04 EP claimed