SCHEMBL8360449

SCHEMBL8360449

C1#CC(c2ccccc2)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 6/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 2/20 0.36
GAA P10253 1/20 0.36
SIGMAR1 Q99720 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
CYP2D6 P10635 2/20 0.34
TSHR P16473 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
APEX1 P27695 1/20 0.33
BLM P54132 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL8358194 1.00 SLC18A3 (0.37) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL8360446 1.00 SLC18A3 (0.37) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL8359813 1.00 SLC18A3 (0.37) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL8356125 1.00 SLC18A3 (0.37) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL8362511 0.98 MEN1 (0.38) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL1533239 0.92 ALDH1A1 (0.34) SLC18A3ALDH1A1GAASIGMAR1SMN1; SMN2
SCHEMBL4670077 0.84 SLC18A3 (0.35) SLC18A3ALDH1A1GAASIGMAR1CYP2D6
SCHEMBL8523558 0.78 MEN1 (0.40) SLC18A3MEN1KMT2AALDH1A1GAA
SCHEMBL21065699 0.73 ESR2 (0.42) CYP2D6CYP2C9
SCHEMBL27972384 0.69 GAA (0.39) ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027177-A Diphenyl ring Xin Guijian albumin, albumin-antineoplastic compound nano particle and its preparation method and application 中山大学孙逸仙纪念医院 2024-05-14 CN claimed
CN-110257051-A A kind of preparation method of the DNA functional quantum point based on click chemistry and its application in biomarker and detection 武汉大学 2019-09-20 CN claimed
CN-118027177-A Diphenyl ring Xin Guijian albumin, albumin-antineoplastic compound nano particle and its preparation method and application 中山大学孙逸仙纪念医院 2024-05-14 CN disclosed
CN-110257051-A A kind of preparation method of the DNA functional quantum point based on click chemistry and its application in biomarker and detection 武汉大学 2019-09-20 CN disclosed
US-5932642-A Cyclic phosphinic acid derivatives as stabilizers CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
EP-0850946-A1 Cyclic phosphinic acid derivatives as stabilizers Ciba SC Holding AG (CH) 1998-07-01 EP disclosed