Propane

Propane

SCHEMBL8855237

C=CC(=O)NCO.CCC

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
ALDH1A1 P00352 4/20 0.56
MAPK1 P28482 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ZDHHC20 Q5W0Z9 1/20 0.52
ZDHHC2 Q9UIJ5 1/20 0.52
TGM2 P21980 6/20 0.38
PSMB5 P28074 1/20 0.34
GAA P10253 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
FAAH O00519 1/20 0.31
HPGD P15428 1/20 0.31
LMNA P02545 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
Alcohol SCHEMBL11584276 0.95 TSHR (0.56) TSHRALDH1A1MAPK1TDP1ZDHHC20
Methyl Alcohol SCHEMBL8855368 0.92
Ethane SCHEMBL9809196 0.92
SCHEMBL1488043 0.92 TSHR (0.65) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL25806 0.92
SCHEMBL7611207 0.91 TSHR (0.52) TSHRALDH1A1MAPK1TDP1ZDHHC20
Acetone SCHEMBL9190129 0.90 ALDH1A1 (0.56) TSHRALDH1A1MAPK1TDP1ZDHHC20
Water SCHEMBL9482345 0.90
SCHEMBL28956758 0.90
Ethylene SCHEMBL10406317 0.90

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-5696177-A LINEAR ADDITION COPOLYMERS CONTAINING HYDROPHILIC MONOMERS WITH SOME HYDROXYL, AMINO OR CARBOXYLATE GROUPS, OR VINYLPYRIDINE OR N-VINYLPYRROLIDONE AND A RESIN CONTAINING EPOXY GROUPS PARTIALLY ESTERIFIED BY (METH)ACRYLIC ACIDS CANON KABUSHIKI KAISHA (JP) 1997-12-09 US disclosed
US-4688052-A Liquid jet recording head having a layer of a resin composition curable with an active energy ray CANON KABUSHIKI KAISHA (JP) 1987-08-18 US disclosed