SCHEMBL15899587

SCHEMBL15899587

CCCOC(C)c1cccc(C)c1OC(=O)Oc1c(C)cccc1C(C)OCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.45
▸ SCN5A Q14524 2/20 0.41
▸ SCN9A Q15858 2/20 0.41
▸ SCN10A Q9Y5Y9 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ SCN4A P35499 5/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ CYP3A4 P08684 2/20 0.36
▸ CYP2D6 P10635 2/20 0.36
▸ NFKB1 P19838 2/20 0.36
▸ THPO P40225 1/20 0.36
▸ NLRP3 Q96P20 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34

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
SCHEMBL15899408 0.92 MAPK1 (0.40) MAPK1SCN5ASCN9ASCN10AL3MBTL1
SCHEMBL15899501 0.88 SCN5A (0.40) MAPK1SCN5ASCN9ASCN10AL3MBTL1
SCHEMBL15899194 0.88 SCN5A (0.39) MAPK1SCN5ASCN9ASCN10AL3MBTL1
SCHEMBL15899428 0.84 SCN4A (0.38) SCN5ASCN9ASCN10AL3MBTL1SMN1; SMN2
SCHEMBL15899131 0.81 SMN1; SMN2 (0.48) L3MBTL1SMN1; SMN2SCN4ACYP1A2CYP2D6
SCHEMBL15899220 0.80 L3MBTL1 (0.41) MAPK1SCN5ASCN9ASCN10AL3MBTL1
SCHEMBL15899348 0.80 MEN1 (0.35) MAPK1SCN5ASCN9ASCN10ASMN1; SMN2
SCHEMBL9229753 0.76 ESR1 (0.45) MAPK1TSHRSCN4ACYP1A2CYP3A4
SCHEMBL15899242 0.72 MEN1 (0.36) SMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL8764787 0.72 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2TSHRKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2759552-B1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO LTD (JP) 2016-02-10 — — EP disclosed
US-9243081-B2 Solid catalyst component for polymerization of olefin, catalyst for polymerization of olefin, and method for producing olefin polymer TOHO TITANIUM CO., LTD. (JP) 2016-01-26 — — US disclosed
US-20140343237-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO., LTD. (JP) 2014-11-20 — — US disclosed
EP-2759552-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER Toho Titanium CO., LTD. (JP) 2014-07-30 — — EP disclosed
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