SCHEMBL15899445

SCHEMBL15899445

CCOC(=O)C(=Cc1ccccc1)C(=O)OCC.CCOC(C)c1cc(C)ccc1OC(=O)Oc1ccc(C)cc1C(C)OCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.55
▸ KMT2A Q03164 9/20 0.55
▸ NR1H4 Q96RI1 1/20 0.45
▸ MAPT P10636 8/20 0.43
▸ LMNA P02545 5/20 0.43
▸ NPSR1 Q6W5P4 3/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ S1PR4 O95977 1/20 0.43
▸ S1PR1 P21453 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ HSP90AA1 P07900 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ POLB P06746 2/20 0.41
▸ PLIN1 O60240 1/20 0.41
▸ PLIN5 Q00G26 1/20 0.41
▸ ABHD5 Q8WTS1 1/20 0.41

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
SCHEMBL15899278 0.84 CYP1A2 (0.36) MEN1KMT2AMAPTLMNACYP1A2
SCHEMBL15899505 0.76 PTGER1 (0.44) KMT2AMAPTLMNAMAPK1ALDH1A1
SCHEMBL935186 0.74 MEN1 (1.00) MEN1KMT2ANR1H4MAPTLMNA
Benzene SCHEMBL27988126 0.74 MEN1 (1.00) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL15899607 0.74 ALDH1A1 (0.39) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL15899397 0.73 ALDH1A1 (0.36) MAPTLMNAMAPK1KDM4EALDH1A1
SCHEMBL15899419 0.72 ALDH1A1 (0.35) MAPTKDM4EALDH1A1GPR55L3MBTL1
SCHEMBL15899583 0.72 MEN1 (0.38) MEN1KMT2AKDM4EALDH1A1L3MBTL1
Butane SCHEMBL6828046 0.72 MEN1 (0.93) MEN1KMT2ANR1H4MAPTLMNA
SCHEMBL1634878 0.71 MEN1 (0.79) MEN1KMT2ANR1H4MAPTLMNA

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
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
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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