SCHEMBL1827677

SCHEMBL1827677

CNCc1ccc2[nH]c(OC(N)=O)c(Sc3cccc(F)c3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
TUBB4A P04350 5/20 0.38
TUBB P07437 5/20 0.38
TUBA3C P0DPH7 5/20 0.38
TUBA1B P68363 5/20 0.38
TUBA4A P68366 5/20 0.38
TUBB4B P68371 5/20 0.38
TUBB3 Q13509 5/20 0.38
TUBB2A Q13885 5/20 0.38
TUBB8 Q3ZCM7 5/20 0.38
TUBA3E Q6PEY2 5/20 0.38
TUBA1A Q71U36 5/20 0.38
TUBA1C Q9BQE3 5/20 0.38
TUBB6 Q9BUF5 5/20 0.38
TUBB2B Q9BVA1 5/20 0.38
TUBB1 Q9H4B7 5/20 0.38
TYMS P04818 1/20 0.36
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SNCA P37840 1/20 0.33

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
SCHEMBL1824781 0.89 TUBB4A (0.44) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1824745 0.89 TUBB4A (0.44) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1616061 0.85 POLB (0.50) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3839280 0.81 TUBB4A (0.44) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1825063 0.80 TUBB4A (0.43) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1827155 0.78 TUBB4A (0.42) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1823740 0.78 TUBB4A (0.38) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1823476 0.78 TUBB4A (0.41) POLBTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL1826220 0.77 TUBB4A (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL4035604 0.77 ACHE (0.40) POLBTUBB4ATUBBTUBA3CTUBA1B

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