SCHEMBL31663069

SCHEMBL31663069

OC[C@H]1CCN(c2ccc3ncc(NCc4ccc5cc[nH]c5c4)nc3n2)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.40
MAP4K4 O95819 1/20 0.36
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
PDE10A Q9Y233 10/20 0.36
KLKB1 P03952 1/20 0.36
KLK1 P06870 1/20 0.36
ABL1 P00519 1/20 0.35
PTGER4 P35408 1/20 0.35

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
SCHEMBL31663010 1.00 MET (0.40) METMAP4K4CCNT1CDK9PDE10A
SCHEMBL31663097 0.95 MAP4K4 (0.43) METMAP4K4CCNT1CDK9ABL1
SCHEMBL31663372 0.95 MAP4K4 (0.43) METMAP4K4CCNT1CDK9ABL1
SCHEMBL31663073 0.95 MET (0.41) METCCNT1CDK9PDE10AABL1
SCHEMBL31663187 0.90 MET (0.39) METCCNT1CDK9PDE10AKLKB1
SCHEMBL31663011 0.90 MET (0.39) METCCNT1CDK9PDE10AKLKB1
SCHEMBL31663243 0.89 MET (0.37) METCCNT1CDK9ABL1
SCHEMBL31662921 0.89 MET (0.37) METCCNT1CDK9PDE10AABL1
SCHEMBL31663352 0.89 MET (0.37) METCCNT1CDK9PDE10AABL1
SCHEMBL31663055 0.89 MET (0.37) METCCNT1CDK9ABL1

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