SCHEMBL4166437

SCHEMBL4166437

Cc1nc(N(C)c2cc(Cl)cc(Cl)c2)sc1C=CC(=O)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CLK1 P49759 1/20 0.31
NR4A2 P43354 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
SCHEMBL4173588 0.88 PTGS2 (0.38) HPGDKMT2ARXRAALDH1A1NR4A2
SCHEMBL4159114 0.79 NR4A2 (0.33) HPGDALDH1A1NR4A2
SCHEMBL4161696 0.78 CCNC (0.39) KMT2AALDH1A1
SCHEMBL4161630 0.74 NR4A2 (0.31) ALDH1A1NR4A2
SCHEMBL4166440 0.73 MAPT (0.52) HPGDKMT2AALDH1A1
SCHEMBL2076088 0.72 NR4A2 (0.35) ALDH1A1NR4A2
SCHEMBL4159231 0.70 KDM4E (0.43) KMT2AALDH1A1NR4A2
SCHEMBL4800668 0.68 HPGD (0.34) HPGDNR4A2
SCHEMBL4167350 0.68 NR4A2 (0.32) HPGDNR4A2
SCHEMBL2075029 0.68 JAK2 (0.42) HPGDKMT2AALDH1A1NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 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-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CDK2, CDK4, CDK20 HPGD 1700/4885KMT2A 1239/4885RXRA 1358/4885

“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.