SCHEMBL30306690

SCHEMBL30306690

NC(=O)NC1CC2(CC(CN3CCCC3c3cccnc3)C2)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ TDP1 Q9NUW8 3/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ OPRK1 P41145 5/20 0.45
▸ OPRM1 P35372 4/20 0.45
▸ OPRD1 P41143 2/20 0.43
▸ BLM P54132 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ CHRNA7 P36544 2/20 0.42
▸ CHRNB2 P17787 2/20 0.42
▸ CHRNB4 P30926 2/20 0.42
▸ CHRNA3 P32297 2/20 0.42
▸ CHRNA4 P43681 2/20 0.42
▸ CHRNA2 Q15822 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HTR3E A5X5Y0 1/20 0.42
▸ PSIP1 O75475 1/20 0.42

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
SCHEMBL30634146 0.83 L3MBTL1 (0.47) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL26633678 0.83 L3MBTL1 (0.47) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL29980501 0.73 ALDH1A1 (0.72) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL3262479 0.72 ALDH1A1 (0.71) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL24011439 0.72 EPHX1 (0.50) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL4387710 0.72 ALDH1A1 (0.58) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL173281 0.72 ALDH1A1 (0.63) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL524920 0.71 ALDH1A1 (0.66) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL3369061 0.71 ALDH1A1 (0.61) ALDH1A1KDM4ETDP1KMT2AMEN1
SCHEMBL2683364 0.71 ALDH1A1 (0.61) ALDH1A1KDM4ETDP1KMT2AMEN1

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-115843295-B NAMPT modulators 赛特凯恩蒂克公司 2025-04-15 — — CN disclosed
CN-115843295-A NAMPT modulators 赛特凯恩蒂克公司 2023-03-24 — — CN disclosed
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