SCHEMBL5837280

SCHEMBL5837280

CC1=Cc2c(-c3cc(C)ccc3C)cccc2C1[Si](C)(C)C1C(C)=Cc2c(-c3cc(C)ccc3C)cccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 5/20 0.33
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
AR P10275 1/20 0.31
ATM Q13315 1/20 0.31
ALDH1A1 P00352 3/20 0.31
HPGD P15428 3/20 0.31
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 2/20 0.31
CYP1A2 P05177 1/20 0.31
NPC1 O15118 1/20 0.31
PDK2 Q15119 1/20 0.31
ELANE P08246 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
CASP3 P42574 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SENP8 Q96LD8 1/20 0.30
SENP7 Q9BQF6 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
SCHEMBL1452689 0.92 MAOA (0.31)
SCHEMBL1452546 0.92 PDK2 (0.32) PDK2
SCHEMBL5836701 0.85 RAB9A (0.37) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL1453207 0.81 CRHR1 (0.33)
SCHEMBL6648868 0.81 CHEK1 (0.40) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL1454590 0.81 ADORA3 (0.33) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL5837897 0.81 CNR2 (0.33)
SCHEMBL5837064 0.79 BRD4 (0.32)
SCHEMBL26606290 0.79
SCHEMBL5836617 0.79 MYC (0.33) NPC1CASP3RAB9ASMN1; SMN2SENP8

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
US-6984743-B1 Method for producing metallocenes BASELL POLYOLEFINE GMBH (DE) 2006-01-10 US disclosed
EP-1015463-B1 METHOD FOR PRODUCING METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2002-12-11 EP disclosed