SCHEMBL22745131

SCHEMBL22745131

C=COCOc1c2n(ncc1=O)CCN(CCC)C2=O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 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
SCHEMBL22745380 0.90 POLB (0.32) POLBGAA
SCHEMBL23636051 0.81 POLB (0.32) POLBGAANPC1LMNARAB9A
SCHEMBL22745311 0.81 POLB (0.34) POLBGAANPC1LMNARAB9A
SCHEMBL19935363 0.81 POLB (0.38) POLBGAANPC1LMNARAB9A
SCHEMBL23636028 0.80 POLB (0.32) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22745132 0.78 POLB (0.33) POLBGAANPC1LMNARAB9A
SCHEMBL19935294 0.78 POLB (0.33) POLBGAANPC1LMNARAB9A
SCHEMBL22745500 0.77 POLB (0.40) POLBGAANPC1LMNARAB9A
SCHEMBL22193785 0.74 POLB (0.36) POLBGAANPC1LMNARAB9A
SCHEMBL22745249 0.74 POLB (0.38) POLBGAANPC1LMNARAB9A

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-3504214-B1 FUSED TRICYCLIC PYRIDAZINONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS NOVARTIS AG (CH) 2020-12-02 — — EP disclosed
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