SCHEMBL12376988

SCHEMBL12376988

CCC(O)CN(C)S(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CRY1 Q16526 11/20 0.46
CRY2 Q49AN0 11/20 0.46
PER2 O15055 9/20 0.46
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MMP1 P03956 2/20 0.36
MMP2 P08253 2/20 0.36
MMP8 P22894 2/20 0.36
MMP13 P45452 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.33
MMP3 P08254 1/20 0.31

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
SCHEMBL17055854 1.00 CRY1 (0.46) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL26471765 1.00 CRY1 (0.46) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL18312488 0.83 CRY1 (0.44) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL15627010 0.82 CRY1 (0.46) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL10510602 0.76 MEN1 (0.43) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL12058794 0.76 MEN1 (0.38) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL18312607 0.76 MEN1 (0.43) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL15354729 0.74 MEN1 (0.37) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL598564 0.74 MEN1 (0.41) CRY1CRY2PER2ALDH1A1MEN1
SCHEMBL15354753 0.74 MEN1 (0.37) CRY1CRY2PER2ALDH1A1MEN1

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-20110201531-A1 Method for Treating Hydrocarbon-Bearing Formations with Fluorinated Epoxides BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-08-18 US disclosed
US-20110136704-A1 Methods of Treating a Hydrocarbon-Bearing Formation, a Well Bore, and Particles BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2011-06-09 US disclosed