SCHEMBL6676500

SCHEMBL6676500

COc1c(C(C)(C)Br)cccc1[Si](C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IDO1 P14902 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
SCHEMBL6677844 0.86 CASR (0.30)
SCHEMBL6677826 0.76 CA2 (0.43) KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL6675500 0.76 MEN1 (0.32) KDM4EALDH1A1
SCHEMBL6678695 0.75 GABRA1 (0.41) KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL5090600 0.75 NQO2 (0.41) KDM4EALDH1A1MAPK1SMN1; SMN2IDO1
SCHEMBL5090518 0.73 CA2 (0.36) KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL6675781 0.73 ACHE (0.36) ALDH1A1SMN1; SMN2IDO1
SCHEMBL10356448 0.72 SMN1; SMN2 (0.47) KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL31443869 0.72 SMN1; SMN2 (0.47) KDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL8443086 0.71 CA1 (0.48) KDM4EALDH1A1MAPK1SMN1; SMN2

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