SCHEMBL28097067

SCHEMBL28097067

C=CC(C=CCCCC)CCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.41
PTGS1 P23219 1/20 0.41
PPARG P37231 1/20 0.41
OPRK1 P41145 1/20 0.41
ALDH1A1 P00352 4/20 0.41
TSHR P16473 4/20 0.41
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CYP3A4 P08684 3/20 0.39
MAPT P10636 4/20 0.33
CYP2D6 P10635 4/20 0.33
CYP1A2 P05177 4/20 0.33
CYP2C9 P11712 4/20 0.33
CYP2C19 P33261 4/20 0.33
MAPK1 P28482 3/20 0.33
TP53 P04637 3/20 0.33
GMNN O75496 2/20 0.33
LMNA P02545 2/20 0.33
GLA P06280 2/20 0.33
POLB P06746 2/20 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
SCHEMBL14481073 0.92 ABCG2 (0.41) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL14481074 0.92 ABCG2 (0.41) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL15547328 0.88 ABCG2 (0.39) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL16581548 0.86 PTGS1 (0.38) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL27605243 0.84 PTGS1 (0.50) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL9104258 0.80 PPARG (0.43) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL10897482 0.79 ABCG2 (0.49) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL10897479 0.79 ABCG2 (0.49) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL29213523 0.78 PPARG (0.45) ABCG2PTGS1PPARGOPRK1ALDH1A1
SCHEMBL28449306 0.78 MEN1 (0.38) ABCG2PTGS1PPARGOPRK1ALDH1A1

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-105849070-B Olefins process 鲁姆斯科技公司 2018-07-06 CN disclosed
CN-105849070-A Olefin conversion process 鲁姆斯科技公司 2016-08-10 CN disclosed