SCHEMBL10154046

SCHEMBL10154046

CNS(=O)(=O)c1cnc(NC(C)=O)s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA3 P07451 2/20 0.54
CA4 P22748 2/20 0.54
CA6 P23280 2/20 0.54
CA5A P35218 2/20 0.54
CA7 P43166 2/20 0.54
CA9 Q16790 2/20 0.54
CA13 Q8N1Q1 2/20 0.54
CA14 Q9ULX7 2/20 0.54
CA5B Q9Y2D0 2/20 0.54
PIK3CG P48736 1/20 0.43
CCNE1 P24864 9/20 0.43
CDK2 P24941 9/20 0.43
CDK1 P06493 3/20 0.43
CDK4 P11802 3/20 0.43
LMNA P02545 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 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
SCHEMBL15882463 0.87 CCNE1 (0.44) CA12CA1CA2CA3CA4
SCHEMBL14419937 0.83 FFAR2 (0.52) CA12CA1CA2CA3CA4
SCHEMBL4860224 0.83 CCNE1 (0.44) CA12CA1CA2CA3CA4
SCHEMBL6078335 0.82 CA2 (0.53) CA12CA1CA2CA3CA4
SCHEMBL540577 0.82 CCNE1 (0.43) CA12CA1CA2CA3CA4
Hydrochloric Acid SCHEMBL28108629 0.82 CCNE1 (0.43) CA12CA1CA2CA3CA4
SCHEMBL16731877 0.81 CCNE1 (0.49) CCNE1CDK2CDK1CDK4LMNA
SCHEMBL10233482 0.79 OGA (0.45) CA12CA1CA2CA3CA4
SCHEMBL1939387 0.79 CCNE1 (0.43) CA12CA1CA2CA3CA4
SCHEMBL27715609 0.78 S1PR1 (0.45) CA12CA1CA2CA3CA4

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-20120165309-A1 HETERO RING DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-28 US disclosed
EP-2397479-A1 HETERO RING DERIVATIVE Astellas Pharma Inc. (JP) 2011-12-21 EP disclosed
WO-2010092962-A1 HETERO RING DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-19 WO 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-20120165309-A1 HETERO RING DERIVATIVE IL2, PIK3R2, IL2RA CA12 4462/4885CA1 4177/4885CA2 2309/4885

“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.