SCHEMBL27635102

SCHEMBL27635102

NC(=O)N[SiH]1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
NFKB1 P19838 2/20 0.32
LMNA P02545 2/20 0.32
CYP1A2 P05177 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
THPO P40225 1/20 0.32
CA2 P00918 1/20 0.32
CYP3A4 P08684 1/20 0.32
CA5A P35218 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL11354262 0.64 CRBN (0.50) TSHRNFKB1LMNACYP1A2MAOA
Cyclopentane SCHEMBL22729196 0.64 CRBN (0.50) TSHRNFKB1LMNACYP1A2MAOA
Cyclohexane SCHEMBL15282041 0.64 TSHR (0.77) TSHRNFKB1LMNACYP1A2MAOA
Hydroxyurea SCHEMBL9377620 0.64
Cyclopentane SCHEMBL9375968 0.64 LMNA (0.77) TSHRNFKB1LMNACYP1A2MAOA
Hydroxyurea SCHEMBL10966425 0.64
Cyclohexane SCHEMBL1882975 0.64 CRBN (0.50) TSHRNFKB1LMNACYP1A2MAOA
Cyclopropane SCHEMBL28293250 0.61
Cyclopentane SCHEMBL2745905 0.61
Cyclohexane SCHEMBL3125968 0.61 LMNA (0.67) TSHRNFKB1LMNACYP1A2MAOA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109232632-A A kind of preparation method of two silicon urea of hexamethyl 丁超 2019-01-18 CN disclosed
CN-102584853-B Preparation method of 7-aminodeacetoxy cephalosporanic acid YILI CHUANNING BIOTECHNOLOGY CO LTD 2014-08-13 CN disclosed
CN-102099427-B Radiation curable printing inks or printing varnishes MARABU GMBH & CO KG 2013-11-13 CN disclosed
CN-102584853-A Preparation method of 7-aminodeacetoxy cephalosporanic acid YILI CHUANNING BIOTECHNOLOGY CO LTD 2012-07-18 CN disclosed
CN-102099427-A Radiation curable printing inks or printing varnishes MARABU GMBH & CO KG 2011-06-15 CN disclosed
CN-100558881-C Engineered bacteria producing penicillium chrysogenum and in the application of producing 7-amino-3-deacetoxy cefaeicosanoic acid NORTH CHINA PHARMACEUTICAL GROUP (CN) 2009-11-11 CN disclosed
CN-1807581-A Engineered bacteria producing penicillium chrysogenum and its uses in producing 7-amido -3-deacetoxy cefaeicosanoic acid NORTH CHINA PHARMACEUTICAL GROUP (CN) 2006-07-26 CN disclosed