SCHEMBL15899428

SCHEMBL15899428

Cc1cccc(C(C)OCC(C)C)c1OC(=O)Oc1c(C)cccc1C(C)OCC(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN4A P35499 7/20 0.38
▸ SCN5A Q14524 3/20 0.38
▸ SCN9A Q15858 3/20 0.38
▸ TSHR P16473 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ SCN1A P35498 2/20 0.38
▸ SCN10A Q9Y5Y9 2/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ NFKB1 P19838 2/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ KCNK3 O14649 1/20 0.38
▸ CACNA1F O60840 1/20 0.38
▸ KCNK2 O95069 1/20 0.38
▸ GBA1 P04062 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ HTR2B P41595 1/20 0.38

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
SCHEMBL15899501 0.87 SCN5A (0.40) SCN4ASCN5ASCN9ATSHRLMNA
SCHEMBL15899587 0.84 MAPK1 (0.45) SCN4ASCN5ASCN9ATSHRLMNA
SCHEMBL15899131 0.82 SMN1; SMN2 (0.48) SCN4ACYP1A2CYP2D6CYP2C9L3MBTL1
SCHEMBL15899408 0.82 MAPK1 (0.40) SCN5ASCN9ASCN10AL3MBTL1
SCHEMBL15899220 0.81 L3MBTL1 (0.41) SCN4ASCN5ASCN9ATSHRLMNA
SCHEMBL15899194 0.81 SCN5A (0.39) SCN4ASCN5ASCN9ATSHRSCN10A
SCHEMBL15899609 0.79 ALDH1A1 (0.33) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL8764787 0.73 L3MBTL1 (0.55) TSHRL3MBTL1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL15899419 0.71 ALDH1A1 (0.35) L3MBTL1ALDH1A1KDM4E
SCHEMBL14967187 0.69 ALDH1A1 (0.50) TSHRCYP3A4SMN1; SMN2ALDH1A1KDM4E

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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