SCHEMBL31035893

SCHEMBL31035893

CCCC(=O)NCCCCCCc1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.75
L3MBTL1 Q9Y468 1/20 0.71
LMNA P02545 1/20 0.70
TSHR P16473 1/20 0.70
TRPV1 Q8NER1 2/20 0.69
ALDH1A1 P00352 1/20 0.64
KMT2A Q03164 1/20 0.64
MTNR1A P48039 1/20 0.60
MTNR1B P49286 1/20 0.60
GAA P10253 2/20 0.59

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
SCHEMBL15598268 0.98 HPGD (0.77) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL27381884 0.89 HPGD (0.83) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL13287459 0.88 HPGD (0.97) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL5933901 0.88 HPGD (0.97) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL15548702 0.88 HDAC3 (0.72) HPGDL3MBTL1LMNATSHRGAA
SCHEMBL31035861 0.87 TRPV1 (0.73) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL31036003 0.87 TRPV1 (0.73) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL31035980 0.87 TRPV1 (0.73) HPGDL3MBTL1LMNATSHRTRPV1
SCHEMBL1690856 0.87 HPGD (0.71) HPGDL3MBTL1ALDH1A1
SCHEMBL18257127 0.86 L3MBTL1 (0.84) HPGDL3MBTL1LMNATSHRTRPV1

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
CN-118255685-A Tricyclic compound, pharmaceutical composition and application thereof 珂阑(上海)医药科技有限公司 2024-06-28 CN disclosed