Propane

Propane

SCHEMBL9248656

CCC.CCC.CCC.CCC

nearest known ligand 0.43

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.43
ALDH1A1 P00352 4/20 0.43
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 2/20 0.33
THRB P10828 1/20 0.33
NFKB1 P19838 1/20 0.33
KCNA1 Q09470 1/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.30
PMP22 Q01453 1/20 0.30
ATM Q13315 1/20 0.30
MAPK1 P28482 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
Propane SCHEMBL1021 1.00
Propane SCHEMBL9246294 1.00
Propane SCHEMBL10956924 1.00 TSHR (0.43) TSHRALDH1A1LMNATDP1THRB
Propane SCHEMBL286506 1.00
Propane SCHEMBL7711629 0.89
Propane SCHEMBL5383086 0.89
Propane SCHEMBL9719556 0.89
Propane SCHEMBL11463258 0.89
Propane SCHEMBL11076973 0.89
Propane SCHEMBL2245238 0.89

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
US-5387628-A Transesterification catalyst; polymerization in presence of organic phosphorus compound and a hindered phenol DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1995-02-07 US disclosed
US-5278279-A Polymerization in presence of an organic phosphorus compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1994-01-11 US disclosed