SCHEMBL7584060

SCHEMBL7584060

CCCCCCCCCCCCCCCC#CC(O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 5/20 0.47
HMGCR P04035 4/20 0.47
RECQL P46063 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
MCL1 Q07820 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL29389418 1.00 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL31112881 1.00 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL31314896 1.00 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL30088469 1.00 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL7749492 1.00 PTPN7 (0.47) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL7925291 0.98 PTPN7 (0.43) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL1101649 0.90
Dodecanol SCHEMBL8503118 0.87 LMNA (0.46) PTPN7HMGCRMEN1ALDH1A1KMT2A
SCHEMBL5461848 0.84 PTPN7 (0.45) PTPN7HMGCRRECQLTDP1KDM4E
SCHEMBL9468881 0.84 PTPN7 (0.45) PTPN7HMGCRRECQLTDP1KDM4E

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-0943612-B1 Process for producing cyclic carbonic esters DAICEL CHEM (JP) 2002-07-24 EP disclosed
US-6054596-A Process for producing cyclic carbonic esters DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-04-25 US disclosed
EP-0943612-A1 Process for producing cyclic carbonic esters Daicel Chemical Industries, Ltd. (JP) 1999-09-22 EP disclosed