SCHEMBL1823976

SCHEMBL1823976

Cc1ccccc1CNCc1ccc2c(Sc3ccccc3)c(OC(N)=O)[nH]c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 5/20 0.40
MAPT P10636 4/20 0.40
POLB P06746 2/20 0.40
TUBB4A P04350 3/20 0.38
TUBB P07437 3/20 0.38
TUBA3C P0DPH7 3/20 0.38
TUBA1B P68363 3/20 0.38
TUBA4A P68366 3/20 0.38
TUBB4B P68371 3/20 0.38
TUBB3 Q13509 3/20 0.38
TUBB2A Q13885 3/20 0.38
TUBB8 Q3ZCM7 3/20 0.38
TUBA3E Q6PEY2 3/20 0.38
TUBA1A Q71U36 3/20 0.38
TUBA1C Q9BQE3 3/20 0.38
TUBB6 Q9BUF5 3/20 0.38
TUBB2B Q9BVA1 3/20 0.38
TUBB1 Q9H4B7 3/20 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
SCHEMBL1823504 0.90 TP53 (0.49) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1824783 0.89 MAPT (0.44) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1826130 0.89 TP53 (0.44) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1823406 0.88 POLB (0.42) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1826315 0.86 TP53 (0.42) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1822442 0.86 TP53 (0.42) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1827585 0.86 TP53 (0.53) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1825505 0.85 ALDH1A1 (0.40) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1823959 0.85 TP53 (0.48) MEN1KMT2ATP53MAPTPOLB
SCHEMBL1615376 0.85 TP53 (0.46) MEN1KMT2ATP53MAPTPOLB

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