SCHEMBL26292546

SCHEMBL26292546

CN(C)CCC(=O)N1CCN(c2ccc(C#N)cn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PANK3 Q9H999 7/20 0.61
▸ RET P07949 1/20 0.55
▸ PARP1 P09874 11/20 0.55
▸ PARP2 Q9UGN5 4/20 0.55
▸ CHRM1 P11229 1/20 0.53

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
SCHEMBL21521132 0.89 PANK3 (0.57) PANK3PARP1PARP2CHRM1
SCHEMBL19748497 0.87 PANK3 (0.64) PANK3PARP1PARP2CHRM1
SCHEMBL31464937 0.85 PANK3 (0.57) PANK3PARP1PARP2CHRM1
SCHEMBL30860008 0.85 PANK3 (0.57) PANK3PARP1PARP2CHRM1
SCHEMBL31464929 0.84 PANK3 (0.61) PANK3PARP1PARP2CHRM1
SCHEMBL15014105 0.84 PANK3 (0.67) PANK3PARP1PARP2CHRM1
SCHEMBL26292516 0.84 PANK3 (0.61) PANK3PARP1PARP2CHRM1
SCHEMBL26291098 0.84 PANK3 (0.61) PANK3PARP1PARP2CHRM1
SCHEMBL30859740 0.84 PANK3 (0.61) PANK3PARP1PARP2CHRM1
Hydrochloric Acid SCHEMBL21520720 0.83 PANK3 (0.60) PANK3PARP1PARP2CHRM1

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-4234551-A2 PYRIDAZINONES AS PARP7 INHIBITORS Ribon Therapeutics Inc. (US) 2023-08-30 — — EP disclosed
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