Propane

Propane

SCHEMBL2218959

CCC.OCc1cc(O)cc(CO)c1O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.45
ACHE P22303 1/20 0.42
KDM4E B2RXH2 2/20 0.41
CASP6 P55212 1/20 0.41
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
ALOX5 P09917 4/20 0.37
PTGS2 P35354 4/20 0.36
PTPN1 P18031 1/20 0.35
PTPN11 Q06124 1/20 0.35
BACE1 P56817 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KLF10 Q13118 1/20 0.34
PDXK O00764 1/20 0.34
MAOA P21397 1/20 0.34
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 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
SCHEMBL9999531 0.92 ACHE (0.48) SHBGACHEKDM4ECASP6GABRA1
SCHEMBL16001171 0.90 GABRA1 (0.46) SHBGACHEKDM4ECASP6GABRA1
Methane SCHEMBL3437667 0.89 ACHE (0.46) SHBGACHEKDM4ECASP6GABRA1
SCHEMBL15449429 0.80 SHBG (0.63) SHBGACHEKDM4ECASP6BACE1
SCHEMBL66559 0.79 ACHE (0.42) SHBGACHEKDM4ECASP6PTPN1
Methane SCHEMBL27819850 0.78 SHBG (0.61) SHBGACHEKDM4ECASP6BACE1
Methane SCHEMBL2220977 0.78 SHBG (0.61) SHBGACHEKDM4ECASP6BACE1
SCHEMBL69820 0.78 GABRA1 (0.55) GABRA1GABRB2ALOX5PTGS2PTPN1
SCHEMBL2221247 0.77 SHBG (0.54) SHBGACHEKDM4ECASP6GABRA1
SCHEMBL19309299 0.77 SHBG (0.44) SHBGACHEKDM4ECASP6ALDH1A1

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
CN-102159992-A Dispersion for disposing fine particle at predetermined point on substrate by ink-jet printing NATOCO CO LTD 2011-08-17 CN disclosed
US-20110173807-A1 DISPERSION FOR DISPOSING FINE PARTICLE AT PREDETERMINED POINT ON SUBSTRATE BY INK-JET PRINTING NATOCO CO., LTD. (JP) 2011-07-21 US disclosed