SCHEMBL4173588

SCHEMBL4173588

Cc1nc(N(C)c2ccc(Cl)cc2)sc1C=CC(=O)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.38
NR4A2 P43354 3/20 0.35
RXRA P19793 2/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
PPARA Q07869 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 3/20 0.34
SMN1; SMN2 Q16637 4/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
GPBAR1 Q8TDU6 1/20 0.32
HTT P42858 1/20 0.32
CHRM1 P11229 1/20 0.32
HTR2A P28223 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL4166437 0.88 HPGD (0.33) NR4A2RXRAHPGDKMT2AALDH1A1
SCHEMBL4161696 0.80 CCNC (0.39) KMT2AALDH1A1MAPTLMNARAB9A
SCHEMBL4159114 0.79 NR4A2 (0.33) NR4A2HPGDALDH1A1MAPTLMNA
SCHEMBL4161630 0.74 NR4A2 (0.31) NR4A2ALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL4173589 0.73 MAPT (0.55) HPGDKMT2AALDH1A1MAPTLMNA
SCHEMBL2076088 0.72 NR4A2 (0.35) NR4A2ALDH1A1MAPTLMNARAB9A
SCHEMBL4159231 0.72 KDM4E (0.43) NR4A2KMT2AALDH1A1MAPTRAB9A
SCHEMBL4167350 0.68 NR4A2 (0.32) NR4A2HPGD
SCHEMBL2075029 0.68 JAK2 (0.42) NR4A2HPGDKMT2AALDH1A1RAB9A
SCHEMBL4800668 0.68 HPGD (0.34) PTGS2NR4A2HPGDMAPTSMN1; SMN2

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 PTGS2 3104/4885NR4A2 1952/4885RXRA 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.