SCHEMBL9546086

SCHEMBL9546086

C=CC(=O)OCCCCCC(C)O

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.68
ALDH1A1 P00352 6/20 0.68
CYP3A4 P08684 4/20 0.68
HPGD P15428 2/20 0.56
TP53 P04637 3/20 0.47
HIF1A Q16665 3/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 4/20 0.40
CYP2C9 P11712 1/20 0.40
THRB P10828 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
HCAR2 Q8TDS4 2/20 0.39
ATM Q13315 1/20 0.37
USP2 O75604 1/20 0.36
ABCB1 P08183 1/20 0.35

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
SCHEMBL23581489 1.00 TSHR (0.68) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL22472162 1.00 TSHR (0.68) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL27800527 0.98 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL1132489 0.98 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL28785945 0.98 TSHR (0.64) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL1017092 0.93 TSHR (0.61) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL25270629 0.87 TSHR (0.70) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL25275202 0.87 TSHR (0.70) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL20503422 0.87 TSHR (0.70) TSHRALDH1A1CYP3A4HPGDTP53
SCHEMBL2778020 0.87 TSHR (0.70) TSHRALDH1A1CYP3A4HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021131504-A1 OPTICAL MULTILAYER BODY AND IMAGE DISPLAY DEVICE 住友化学株式会社 2021-07-01 WO disclosed
WO-2021131506-A1 OPTICAL LAMINATE AND IMAGE DISPLAYING DEVICE 住友化学株式会社 2021-07-01 WO disclosed
WO-1993023773-A1 PROCESS FOR PREPARATION OF OXYGEN PERMEABLE POLYMER MATERIAL CIBA-GEIGY AG (CH) 1993-11-25 WO disclosed