Propene

Propene

SCHEMBL28153646

C=C(C)C(=O)OCCCC.C=C(C)C(=O)OCc1ccccc1.C=CC

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.56
TDP1 Q9NUW8 4/20 0.56
ALDH1A1 P00352 3/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
CYP3A4 P08684 1/20 0.56
MAPK1 P28482 1/20 0.56
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
HTT P42858 1/20 0.47
CETP P11597 3/20 0.41
MBOAT4 Q96T53 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TGM2 P21980 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
Propene SCHEMBL28187730 0.93 TSHR (0.52) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL7852013 0.90 TSHR (0.55) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL10599434 0.90 TSHR (0.56) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL28476399 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL18990497 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL28102570 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL8945466 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL7107538 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL28154418 0.89 TSHR (0.67) TSHRTDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL8861672 0.87 TSHR (0.52) TSHRTDP1ALDH1A1L3MBTL1CYP3A4

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-105538908-B Recording method and recording equipment 佳能株式会社 2017-07-18 CN disclosed