SCHEMBL22755049

SCHEMBL22755049

Cc1c[nH]c(=O)c2c(C(=O)NC3CCN(Cc4ccccc4)CC3)c[nH]c12

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.64
▸ SIGMAR1 Q99720 1/20 0.58
▸ DRD4 P21917 1/20 0.53
▸ SLC6A12 P48065 3/20 0.53
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ MAOB P27338 2/20 0.51
▸ KCNH2 Q12809 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51

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
SCHEMBL22754937 0.94 POLB (0.56) POLBSIGMAR1DRD4
SCHEMBL22755067 0.85 MDM4 (0.46) POLBMEN1KMT2ASMN1; SMN2
SCHEMBL22755258 0.81 LIPG (0.48) —
SCHEMBL22755113 0.80 ADORA2A (0.48) MEN1KMT2ALMNASMN1; SMN2
SCHEMBL22754845 0.79 NPC1 (0.50) POLBMEN1KMT2ALMNASMN1; SMN2
SCHEMBL22755022 0.78 LIPG (0.40) POLB
SCHEMBL22755092 0.78 BACE1 (0.41) KMT2A
SCHEMBL10778956 0.76 SIGMAR1 (0.71) POLBSIGMAR1DRD4SLC6A12KMT2A
SCHEMBL22755368 0.76 MTNR1A (0.49) MAOBLMNA
SCHEMBL22754848 0.75 KDM4E (0.55) POLBMEN1KMT2A

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-3747885-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2020-12-09 — — EP disclosed
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