SCHEMBL28857582

SCHEMBL28857582

Cc1cc(C)n(Cc2ccc(C(=O)Nc3ccccc3Nc3ccccc3)o2)n1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.68
▸ POLB P06746 3/20 0.66
▸ KDM4E B2RXH2 1/20 0.65
▸ HTT P42858 1/20 0.63
▸ HIF1A Q16665 3/20 0.61
▸ EPAS1 Q99814 3/20 0.61
▸ KMT2A Q03164 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MAPT P10636 4/20 0.47
▸ HPGD P15428 1/20 0.45

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
SCHEMBL28857649 0.90 LMNA (0.78) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857664 0.89 KDM4E (0.68) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857594 0.88 LMNA (0.76) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857622 0.87 POLB (0.64) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857644 0.86 POLB (0.63) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857579 0.84 LMNA (0.70) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857628 0.83 LMNA (0.62) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857623 0.81 LMNA (0.71) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857608 0.81 LMNA (0.71) LMNAPOLBKDM4EHTTHIF1A
SCHEMBL28857637 0.81 KDM4E (0.71) LMNAPOLBKDM4EHTTHIF1A

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
CN-115160269-A Arylcarboxamide derivatives as positive allosteric modulators of NMDAR 北京大学 2022-10-11 — — CN claimed
CN-115160269-A Arylcarboxamide derivatives as positive allosteric modulators of NMDAR 北京大学 2022-10-11 — — CN disclosed
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