Propene

Propene

SCHEMBL28249246

C=CC.Cc1cc(C)c(C(=O)[PH](=O)C(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 1/20 0.35
TAS1R3 Q7RTX0 3/20 0.34
TAS1R1 Q7RTX1 3/20 0.34
TAS1R2 Q8TE23 3/20 0.34
HPGD P15428 2/20 0.33
KDM4E B2RXH2 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31

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
SCHEMBL460621 0.90 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2HPGDKDM4E
SCHEMBL22157679 0.88 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2HPGDKDM4E
SCHEMBL22157783 0.88 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2HPGDKDM4E
Ethane SCHEMBL8533300 0.88 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2HPGDKDM4E
Benzene SCHEMBL28241020 0.86 KDM4E (0.40) TAS1R3TAS1R1TAS1R2HPGDKDM4E
SCHEMBL28233914 0.82 KDM4E (0.33) TAS1R3TAS1R1TAS1R2HPGDKDM4E
Dodecane SCHEMBL8532955 0.78 HPGD (0.39) HPGDKDM4EKMT2AL3MBTL1MEN1
SCHEMBL895435 0.78 CES2 (0.41) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL28376873 0.78 TAS1R3 (0.37) TAS1R3TAS1R1TAS1R2HPGDKDM4E
SCHEMBL4244313 0.75 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2HPGDKDM4E

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-108751984-A A kind of zirconia-based ceramics material and its preparation method and application 广东工业大学 2018-11-06 CN disclosed