SCHEMBL17614835

SCHEMBL17614835

CC(C)SC(=O)NC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
EPHX1 P07099 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CTSK P43235 1/20 0.31
PIK3CD O00329 1/20 0.30
HDAC2 Q92769 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
SCHEMBL11014966 0.70
SCHEMBL26568239 0.70 POLB (0.35) POLBPIK3CDHDAC2
SCHEMBL19484938 0.70 MEN1 (0.43) POLBEPHX1MEN1KMT2A
SCHEMBL9910982 0.69 EPHX1 (0.36) POLBEPHX1MEN1KMT2A
SCHEMBL11718113 0.69
SCHEMBL13884523 0.69 CA12 (0.39) EPHX1MEN1KMT2A
SCHEMBL17663622 0.67 SIGMAR1 (0.38) CTSK
SCHEMBL42259 0.66
SCHEMBL18594653 0.65 POLB (0.46) POLBMEN1KMT2APIK3CDHDAC2
SCHEMBL23084588 0.65 POLB (0.46) POLBEPHX1MEN1KMT2APIK3CD

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
WO-2018028365-A1 DYNAMIC POLYMER WITH HYBRID CROSS-LINKED NETWORK AND APPLICATION THEREOF 翁秋梅 2018-02-15 WO disclosed
US-20170301953-A1 FUNCTIONALIZED SILANES AND ELECTROLYTE COMPOSITIONS AND ELECTROCHEMICAL DEVICES CONTAINING THEM ORBIA FLUOR & ENERGY MATERIALS USA, INC. 2017-10-19 US disclosed
US-20160082123-A1 Hydrogel-Linked Prodrugs Releasing Tagged Drugs ASCENDIS PHARMA A/S (DK) 2016-03-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170301953-A1 FUNCTIONALIZED SILANES AND ELECTROLYTE COMPOSITIONS AND ELECTROCHEMICAL DEVICES CONTAINING THEM ZYX, HCN4, HCN3 POLB 1573/4885EPHX1 2906/4885MEN1 1634/4885
US-20160082123-A1 Hydrogel-Linked Prodrugs Releasing Tagged Drugs PTMS, PGLS, PAM POLB 3230/4885EPHX1 164/4885MEN1 3497/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.