SCHEMBL22743450

SCHEMBL22743450

Cc1n[nH]c(=O)c2c1CC1C(C2)C1(F)F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.31
▸ HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL22743562 0.77 PDPK1 (0.33) PDPK1HCAR2
SCHEMBL22744355 0.76 DYRK1A (0.31) —
SCHEMBL22743477 0.68 TNKS (0.32) PDPK1
SCHEMBL19902649 0.66 PARP1 (0.42) —
SCHEMBL22743476 0.66 PARP1 (0.45) —
SCHEMBL19152895 0.63 WNT3A (0.38) PDPK1
SCHEMBL18237905 0.63 WNT3A (0.38) PDPK1
SCHEMBL22743690 0.62 PDPK1 (0.31) PDPK1
SCHEMBL19152937 0.61 PDPK1 (0.33) PDPK1
SCHEMBL19152636 0.61 PDPK1 (0.33) PDPK1

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-2020239076-A1 PYRIDAZINONE DERIVATIVES AS THYROXINE RECEPTOR-Β AGONISTS AND APPLICATION THEREOF 南京明德新药研发有限公司 2020-12-03 — — WO disclosed
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