SCHEMBL15664003

SCHEMBL15664003

COc1cnc2c(Oc3ccc(Nc4nnc(-c5ccc(C(N)=O)cc5)c5ccccc45)cc3)ccnc2c1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.67
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
MAPT P10636 3/20 0.56
ALDH1A1 P00352 2/20 0.54
HTT P42858 2/20 0.54
POLB P06746 2/20 0.54
BRAF P15056 1/20 0.54
THRB P10828 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ENPP3 O14638 1/20 0.51
LMNA P02545 1/20 0.50
PRNP P04156 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL2209836 0.91 MAPT (0.58) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL2204168 0.89 MAPT (0.53) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL2974053 0.88 MAPT (0.52) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL2209628 0.88 MAPT (0.52) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL2210397 0.88 MAPT (0.52) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL15663446 0.86 ENPP3 (0.56) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL2208507 0.86 MAPT (0.50) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL15663317 0.86 ALDH1A1 (0.51) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL15663366 0.86 MAPT (0.50) KDRMEN1KMT2AMAPTALDH1A1
SCHEMBL15663604 0.86 MAPT (0.50) KDRMEN1KMT2AMAPTALDH1A1

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-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 EP disclosed