SCHEMBL18790695

SCHEMBL18790695

Cc1ccccc1-c1cnnc(N2CCN(CC(N)=O)CC2)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 6/20 0.67
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CYP11B1 P15538 2/20 0.40
▸ GRIN2B Q13224 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SLC6A7 Q99884 1/20 0.37
▸ TRPV1 Q8NER1 3/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ DRD4 P21917 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ LOXL2 Q9Y4K0 1/20 0.36

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
SCHEMBL18790697 0.91 CYP11B2 (0.69) CYP11B2KMT2AMEN1POLBCYP11B1
SCHEMBL18790705 0.87 CYP11B2 (0.65) CYP11B2KMT2AMEN1POLBCYP11B1
SCHEMBL18791038 0.86 CYP11B2 (0.64) CYP11B2KMT2AMEN1POLBCYP11B1
SCHEMBL18790694 0.84 CYP11B2 (0.61) CYP11B2KMT2AMEN1POLBCYP11B1
SCHEMBL18791026 0.78 GAA (0.53) CYP11B2CYP11B1DRD2DRD4DRD3
SCHEMBL18791106 0.77 CYP11B2 (0.53) CYP11B2KMT2AMEN1CYP11B1MAPT
SCHEMBL18791036 0.76 HTR7 (0.56) CYP11B2KMT2AMEN1
SCHEMBL18790708 0.76 CYP11B2 (0.58) CYP11B2CYP11B1GRIN2B
SCHEMBL18791104 0.75 CYP11B2 (0.51) CYP11B2KMT2AMEN1CYP11B1MAPT
SCHEMBL3436278 0.71 LMNA (0.55) MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3381904-B1 NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2021-07-28 — — EP disclosed
WO-2017069226-A1 NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND 田辺三菱製薬株式会社 2017-04-27 — — WO disclosed
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