SCHEMBL6672465

SCHEMBL6672465

C=CCOc1c(C(C)(C)Br)ccc(C)c1[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.33
PTGS2 P35354 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HPGD P15428 2/20 0.30
GAA P10253 1/20 0.30
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
TP53 P04637 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL5086394 0.80 LMNA (0.34) PTGS1PTGS2MAPTLMNANPSR1
SCHEMBL6675579 0.77 MEN1 (0.33) MEN1KMT2AHTTMAPTLMNA
SCHEMBL6674671 0.74 ALDH1A1 (0.40) MEN1KMT2AHTTLMNAALDH1A1
SCHEMBL6675500 0.70 MEN1 (0.32) MEN1KMT2AHTTLMNAALDH1A1
SCHEMBL6672811 0.69 ALDH1A1 (0.35) MEN1KMT2AHTTLMNAALDH1A1
SCHEMBL6673416 0.68 MEN1 (0.34) PTGS1PTGS2MEN1KMT2AHTT
SCHEMBL5089753 0.68 MEN1 (0.40) PTGS1PTGS2MEN1KMT2AHTT
SCHEMBL6678272 0.68 HPGD (0.44) MEN1KMT2AHTTMAPTLMNA
SCHEMBL6671782 0.67 MEN1 (0.32) PTGS1PTGS2MEN1KMT2AHTT
SCHEMBL5090584 0.66 MGAM (0.32) PTGS1PTGS2MAPTGAA

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-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed