SCHEMBL5314209

SCHEMBL5314209

C1CCC2CCCCC2C1.CC1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.57
▸ ACHE P22303 1/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ EPHX1 P07099 1/20 0.37
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA4 P22748 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ SLC18A3 Q16572 1/20 0.32
▸ CA12 O43570 1/20 0.31
▸ CA7 P43166 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ OPRK1 P41145 2/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL11014745 0.91 ALDH1A1 (0.47) ALDH1A1ACHEKMT2AEPHX1TDP1
SCHEMBL23571227 0.91 ALDH1A1 (0.47) ALDH1A1ACHEKMT2AEPHX1TDP1
SCHEMBL13668411 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL11829644 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL22938022 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL8764310 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL16071650 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL5917552 0.90 ALDH1A1 (0.53) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL447245 0.89 ACHE (0.43) ALDH1A1ACHEKMT2AEPHX1CA1
SCHEMBL866985 0.89 ACHE (0.43) ALDH1A1ACHEKMT2AEPHX1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 — — CN claimed
CN-117446750-A Organic hydride compound system and application 中国石油大学(华东) 2024-01-26 — — CN disclosed
CN-1781473-B Medical multilayer container and multichamber container NIPRO CORP 2015-01-07 — — CN disclosed
CN-102423282-B Medical multi-layered container and plural chamber container NIPRO CORP 2014-07-23 — — CN disclosed
CN-102423282-A Medical multi-layer multi-chamber container NIPRO CORP 2012-04-25 — — CN disclosed
EP-1629974-B1 Medical multi-layered container and plural chamber container NIPRO CORP (JP) 2007-10-03 — — EP disclosed
CN-1781473-A Medical multilayer container and multichamber container NIPRO CORP (JP) 2006-06-07 — — CN disclosed
EP-1629974-A1 Medical multi-layered container and plural chamber container Nipro Corporation (JP) 2006-03-01 — — EP disclosed
US-20060035044-A1 Multi-layered medical container and medical plural chamber container NIPRO CORPORATION (JP) 2006-02-16 — — US disclosed
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