SCHEMBL23635153

SCHEMBL23635153

CC1=C(c2cc(Cl)cc(N3CCN(C)CC3)c2)C=CC(NC(=O)c2cnc(C)nc2)=C=C1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.37
RAB9A P51151 6/20 0.37
DYRK1A Q13627 1/20 0.36
RORC P51449 1/20 0.35
LDLR P01130 1/20 0.35
PCSK9 Q8NBP7 1/20 0.35
HDAC3 O15379 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
NPC1 O15118 3/20 0.34
FGFR1 P11362 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
SRC P12931 1/20 0.33
AURKA O14965 1/20 0.33
TTK P33981 1/20 0.33
AURKB Q96GD4 1/20 0.33
INCENP Q9NQS7 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
SCHEMBL23635154 0.86 PIK3CA (0.39)
SCHEMBL24187480 0.77 RAB9A (0.51) F10RAB9ALDLRPCSK9NPC1
SCHEMBL17027818 0.76 F10 (0.54) F10RAB9ADYRK1A
SCHEMBL23635162 0.75 DYRK1A (0.34) RAB9ADYRK1ALDLRPCSK9HDAC3
SCHEMBL18979408 0.74 HDAC2 (0.44) F10RAB9ADYRK1ALDLRPCSK9
SCHEMBL17027749 0.73 F10 (0.48) F10RAB9ADYRK1A
SCHEMBL23635155 0.73 LDLR (0.38) RAB9ADYRK1ALDLRPCSK9HDAC1
SCHEMBL18996612 0.67 DYRK1A (0.48) F10DYRK1A
SCHEMBL17027809 0.66 DYRK1A (0.42) F10DYRK1A
SCHEMBL18979456 0.65 F10 (0.61) F10DYRK1AHDAC3HDAC2

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