SCHEMBL31662945

SCHEMBL31662945

CCc1ccc2ncc(NCc3ccc4cc[nH]c4c3)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.46
MET P08581 1/20 0.42
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
CCNT1 O60563 1/20 0.38
CDK9 P50750 1/20 0.38
BACE1 P56817 5/20 0.38
SRC P12931 1/20 0.37
NMT1 P30419 1/20 0.36
F2 P00734 1/20 0.35
P2RX3 P56373 1/20 0.35
P2RX2 Q9UBL9 1/20 0.35
NLRP3 Q96P20 1/20 0.35
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
APP P05067 1/20 0.34
LMNA P02545 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PDE10A Q9Y233 1/20 0.33
METTL3 Q86U44 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
SCHEMBL31663283 0.88 ABL1 (0.44) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663280 0.86 AHR (0.46) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663182 0.85 PDE10A (0.46) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663349 0.85 MEN1 (0.49) ABL1METPDGFRBPDGFRASRC
SCHEMBL31662867 0.85 MET (0.47) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663355 0.84 ABL1 (0.44) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663079 0.83 CCNT1 (0.40) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663339 0.83 MET (0.53) ABL1METPDGFRBPDGFRABACE1
SCHEMBL31663077 0.81 MET (0.47) ABL1METPDGFRBPDGFRACCNT1
SCHEMBL31663364 0.78 ABL1 (0.41) ABL1METPDGFRBPDGFRACCNT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025149622-A1 WNK1 INHIBITORS DANIA THERAPEUTICS APS (DK) 2025-07-17 WO claimed
WO-2025149622-A1 WNK1 INHIBITORS DANIA THERAPEUTICS APS (DK) 2025-07-17 WO disclosed