SCHEMBL1713693

SCHEMBL1713693

O=C1NC(=S)NC1=Cc1c[nH]c2ncc(-c3ccccc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.49
AXL P30530 7/20 0.49
CDK8 P49336 4/20 0.49
TNIK Q9UKE5 1/20 0.49
GSK3B P49841 1/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SGK1 O00141 4/20 0.44
CAMKK2 Q96RR4 2/20 0.44
MMP2 P08253 1/20 0.43
MMP3 P08254 1/20 0.43
MMP13 P45452 1/20 0.43
MMP14 P50281 1/20 0.43
TOP1 P11387 1/20 0.42

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
SCHEMBL1713692 1.00 IDH1 (0.49) IDH1AXLCDK8TNIKGSK3B
SCHEMBL1713644 0.84 KMT2A (0.44) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1713646 0.84 KMT2A (0.44) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714038 0.84 KMT2A (0.44) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714042 0.84 KMT2A (0.44) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714495 0.82 MEN1 (0.42) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714497 0.82 MEN1 (0.42) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714096 0.81 APAF1 (0.42) IDH1MEN1KMT2ATOP1
SCHEMBL12460055 0.81 MEN1 (0.41) IDH1MEN1KMT2AMMP2MMP3
SCHEMBL1714704 0.81 MEN1 (0.41) IDH1MEN1KMT2AMMP2MMP3

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
US-8314121-B2 Imidazolone derivatives, preparation thereof as drugs, pharmaceutical compositions, and use thereof as protein kinase inhibitors, in particular CDC7 SANOFI (FR) 2012-11-20 US disclosed
EP-2094699-B1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 SANOFI AVENTIS (FR) 2011-07-20 EP disclosed
US-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 SANOFI-AVENTIS (FR) 2009-10-08 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 (1 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-20090253679-A1 NEW IMIDAZOLONE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS, AND USE THEREOF AS PROTEIN KINASE INHIBITORS, IN PARTICULAR CDC7 CDC7, CDK7, CDK17 IDH1 1175/4885AXL 533/4885CDK8 119/4885

“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.