SCHEMBL30319376

SCHEMBL30319376

CC(C)CNC(C)c1n[nH]c(=O)c2cc(F)c(F)cc12

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ PARP1 P09874 3/20 0.32
▸ ALPL P05186 1/20 0.32
▸ AR P10275 2/20 0.31
▸ PRMT5 O14744 1/20 0.31
▸ WDR77 Q9BQA1 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL30319380 1.00 POLB (0.34) POLBTSHRPARP1ALPLAR
SCHEMBL30319383 0.87 TSHR (0.36) POLBTSHRPARP1ARMEN1
SCHEMBL30319444 0.87 TSHR (0.36) POLBTSHRPARP1ARMEN1
SCHEMBL30319375 0.85 POLB (0.37) POLBTSHRPARP1
SCHEMBL24097324 0.82 POLB (0.37) POLBTSHRPARP1ARPRMT5
SCHEMBL30319328 0.82 POLB (0.37) POLBTSHRPARP1ARPRMT5
SCHEMBL30319342 0.82 POLB (0.37) POLBTSHRPARP1ARPRMT5
Hydrochloric Acid SCHEMBL30319325 0.81 POLB (0.36) POLBTSHRPARP1ARPRMT5
SCHEMBL30319362 0.80 ALPL (0.38) POLBTSHRPARP1ALPLHTT
SCHEMBL30319330 0.80 POLB (0.55) POLBTSHRPARP1ARPRMT5

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-4161905-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF Arbutus Biopharma Corporation (CA) 2023-04-12 — — EP disclosed
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