Pentane

Pentane

SCHEMBL8679357

CC(C)C[Al](CC(C)C)CC(C)C.CCCCC

nearest known ligand 0.44

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
LMNA P02545 1/20 0.44
OPRM1 P35372 1/20 0.33
THRB P10828 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.32

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
Hexane SCHEMBL20240180 0.94 TSHR (0.41) TSHRLMNAOPRM1THRBTRPM8
Octane SCHEMBL29076104 0.91 TSHR (0.47) TSHRLMNAOPRM1THRBTRPM8
Heptane SCHEMBL3905264 0.91 TSHR (0.47) TSHRLMNAOPRM1THRBTRPM8
Butane SCHEMBL27598957 0.87
SCHEMBL3835334 0.86 TSHR (0.32) TSHRLMNA
SCHEMBL22471586 0.84 TSHR (0.31) TSHR
SCHEMBL15141 0.83 TSHR (0.33) TSHR
SCHEMBL3819026 0.83 TSHR (0.33) TSHR
SCHEMBL9408974 0.82 TSHR (0.33) TSHRLMNAOPRM1THRBTRPM8
SCHEMBL733085 0.82 TSHR (0.33) TSHRLMNAOPRM1THRBTRPM8

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-1239522-C Polymer supported catalyst for olefin polymerization EXXON CHEMICAL PATENTS INC (US) 2006-02-01 CN disclosed
CN-1291996-A Polymeric supported catalysts for olefin polymerization EXXON CHEMICAL PATENTS INC (US) 2001-04-18 CN disclosed
CN-1182439-A Solution polymerization process for ethylene-alpha-olefin/diene polymers EXXON CHEMICAL PATENTS INC (US) 1998-05-20 CN disclosed
EP-0821703-A1 ETHYLENE-$g(a)-OLEFIN/DIOLEFIN POLYMER SOLUTION POLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 1998-02-04 EP disclosed
US-5696213-A HEATING IN PRESENCE OF A CATALYST SYSTEM EXXON CHEMICAL PATENTS INC. (US) 1997-12-09 US disclosed
WO-1996033227-A1 ETHYLENE-α-OLEFIN/DIOLEFIN POLYMER SOLUTION POLYMERIZATION PROCESS EXXON CHEMICAL PATENTS INC. (US) 1996-10-24 WO disclosed