SCHEMBL11929009

SCHEMBL11929009

CNS(=O)(=O)c1cc(C2(O)NC(=O)c3ccccc32)ccc1Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.73
CA12 O43570 1/20 0.73
CA1 P00915 1/20 0.73
CA2 P00918 1/20 0.73
CA3 P07451 1/20 0.73
CA4 P22748 1/20 0.73
CA6 P23280 1/20 0.73
CA5A P35218 1/20 0.73
CA7 P43166 1/20 0.73
CA9 Q16790 1/20 0.73
CA14 Q9ULX7 1/20 0.73
CA5B Q9Y2D0 1/20 0.73
PTPN1 P18031 1/20 0.56
GSTO1 P78417 1/20 0.39
POLB P06746 1/20 0.38
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL10281227 0.88 MAPT (0.69) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL26234 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL29687442 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
(R)-Chlorthalidone SCHEMBL30872862 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL164949 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL4425734 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
(R)-Chlorthalidone SCHEMBL827454 0.85 CA1 (1.00) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL28520875 0.84 CA1 (0.98) MAPTCA12CA1CA2CA3
Chlorthalidone SCHEMBL7305527 0.83 CA1 (0.91) MAPTCA12CA1CA2CA3
SCHEMBL10442372 0.82 MAPT (0.61) MAPTCA12CA1CA2CA3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180194732-A1 MULTI-API LOADING PRODRUGS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-07-12 US disclosed
US-20160024011-A1 Multi-API Loading Prodrugs ALKERMES PHARMA IRELAND LTD (IE) 2016-01-28 US disclosed
US-20120202823-A1 Multi-API Loading Prodrugs ALKERMES, INC. 2012-08-09 US disclosed
US-7544711-B2 Use of nitroderivatives in urinary incontinence NICOX S.A. (FR) 2009-06-09 US disclosed
US-7282519-B2 Nitrosated and nitrosylated diuretic compounds, compositions and methods of use NITROMED, INC. (US) 2007-10-16 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 (3 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-20160024011-A1 Multi-API Loading Prodrugs AADAC, PAICS, ABCG2 MAPT 4018/4885CA12 540/4885CA1 770/4885
US-20120202823-A1 Multi-API Loading Prodrugs AADAC, PAICS, ABCG2 MAPT 4018/4885CA12 540/4885CA1 770/4885
US-20180194732-A1 MULTI-API LOADING PRODRUGS AADAC, PAICS, ABCG2 MAPT 4018/4885CA12 540/4885CA1 770/4885

“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.