SCHEMBL24820402

SCHEMBL24820402

Cc1nc2cc(C(=O)Nc3nccn3C)cc(C(F)(F)F)c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.43
RPS6KA3 P51812 1/20 0.39
RPS6KA2 Q15349 1/20 0.39
NTRK1 P04629 7/20 0.37
POLB P06746 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.35
USP1 O94782 1/20 0.33
FDPS P14324 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
SORT1 Q99523 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL24820407 0.77 RXRA (0.32) LMNA
SCHEMBL24821729 0.74 TDP1 (0.47) POLBKDM4EMAPTNPC1RAB9A
SCHEMBL3894242 0.72 HPGDS (0.50) HPGDSRPS6KA3RPS6KA2KDM4EMAPT
SCHEMBL11499102 0.70 HPGDS (0.54) HPGDSRPS6KA3RPS6KA2POLBKDM4E
SCHEMBL24820335 0.70 HPGD (0.43) POLBKDM4ELMNAMEN1NPC1
SCHEMBL3896671 0.69 HPGDS (0.49) HPGDSRPS6KA3RPS6KA2POLBKDM4E
SCHEMBL24820414 0.66 ACACB (0.45) MEN1KMT2A
SCHEMBL16789782 0.66 MAPT (0.41) POLBKDM4EMAPT
SCHEMBL24820416 0.65 HDAC4 (0.44) NPC1RAB9AKMT2A
SCHEMBL24820405 0.65 HDAC4 (0.44) NPC1RAB9AKMT2A

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
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 WO disclosed