SCHEMBL15969801

SCHEMBL15969801

CCCCC(CC(=O)OCC)c1ccccc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TSHR P16473 2/20 0.43
PPARG P37231 2/20 0.42
DHFR P00374 1/20 0.41
EGFR P00533 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PLIN1 O60240 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
PLIN5 Q00G26 1/20 0.41
ABHD5 Q8WTS1 1/20 0.41
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
F2 P00734 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
SCHEMBL9163983 0.86 PPARG (0.41) POLBHTTNPSR1L3MBTL1PPARG
SCHEMBL18151306 0.83 POLB (0.58) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL28362367 0.83 TSHR (0.51) POLBL3MBTL1TSHRLMNACYP3A4
SCHEMBL15969857 0.82 POLB (0.50) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL8128981 0.81 POLB (0.55) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL28008718 0.80 F2 (0.58) POLBNPSR1TSHRMEN1KMT2A
SCHEMBL15968923 0.79 POLB (0.48) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL312971 0.79 POLB (0.48) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL5720966 0.76 TSHR (0.44) POLBHTTNPSR1L3MBTL1TSHR
SCHEMBL14874586 0.76 TSHR (0.43) POLBHTTNPSR1L3MBTL1TSHR

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
EP-2768873-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2017-11-22 EP disclosed
US-8921253-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-12-30 US disclosed
US-20140243490-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2014-08-28 US disclosed