SCHEMBL23635162

SCHEMBL23635162

Cc1ncc(C(=O)NC2=C=CC=C(c3cc(C4CC4)cc(N4CCN(C)CC4)c3)C=C2)cn1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.34
LDLR P01130 1/20 0.34
PCSK9 Q8NBP7 1/20 0.34
MAPK14 Q16539 4/20 0.33
BRD4 O60885 1/20 0.33
BRAF P15056 4/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ABL1 P00519 2/20 0.33
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
RIPK2 O43353 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
BCR P11274 1/20 0.32
DDR1 Q08345 1/20 0.32
DDR2 Q16832 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
GSK3B P49841 1/20 0.32

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
SCHEMBL23635155 0.88 LDLR (0.38) DYRK1ALDLRPCSK9MAPK14BRD4
SCHEMBL18996612 0.78 DYRK1A (0.48) DYRK1AABL1GSK3B
SCHEMBL17027809 0.76 DYRK1A (0.42) DYRK1AABL1GSK3B
SCHEMBL23635153 0.75 F10 (0.37) DYRK1ALDLRPCSK9HDAC3HDAC1
SCHEMBL23635154 0.72 PIK3CA (0.39)
SCHEMBL23635137 0.71 DYRK1A (0.39) DYRK1AABL1GSK3B
SCHEMBL23635161 0.69 DYRK1A (0.44) DYRK1AABL1GSK3B
SCHEMBL24187480 0.66 RAB9A (0.51) LDLRPCSK9RAB9ANPC1L3MBTL1
SCHEMBL17027818 0.64 F10 (0.54) DYRK1ARAB9AGSK3B
SCHEMBL17027858 0.64 DYRK1A (0.47) DYRK1ALDLRPCSK9HDAC1ABL1

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-3107909-B1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC INC (US) 2021-07-14 EP disclosed