Propane

Propane

SCHEMBL28845720

C=C(C)OCc1ccccc1.CCC

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
TDP1 Q9NUW8 3/20 0.47
MAPK1 P28482 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 2/20 0.44
CYP3A4 P08684 1/20 0.44
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HCAR2 Q8TDS4 1/20 0.43
IDO1 P14902 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL156493 0.96 ALDH1A1 (0.63) ALDH1A1TDP1MAPK1L3MBTL1CA12
Ethylene Glycol SCHEMBL15012420 0.90 ALDH1A1 (0.57) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL13176595 0.79 ALDH1A1 (0.53) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL9926611 0.79 ALDH1A1 (0.59) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL21518223 0.78 ALDH1A1 (0.63) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL27313233 0.78 ALDH1A1 (0.68) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL27509184 0.78 ALDH1A1 (0.56) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL18427393 0.78 ALDH1A1 (0.68) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL40338 0.78 ALDH1A1 (0.68) ALDH1A1TDP1MAPK1L3MBTL1CA12
SCHEMBL4246837 0.78 ALDH1A1 (0.56) ALDH1A1TDP1MAPK1L3MBTL1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105008483-B Solar cell screening glass and solar battery module 东洋油墨SC控股株式会社 2017-07-14 CN disclosed