SCHEMBL4158719

SCHEMBL4158719

CCNS(=O)(=O)c1ccc(NC(=N)N)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.58
CYP2C9 P11712 1/20 0.57
ALDH1A1 P00352 9/20 0.55
KMT2A Q03164 5/20 0.55
NPC1 O15118 1/20 0.55
TSHR P16473 2/20 0.53
POLB P06746 1/20 0.51
MEN1 O00255 3/20 0.50
MAPT P10636 3/20 0.50
ALOX15 P16050 2/20 0.50
MAPK1 P28482 2/20 0.50
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
OPRM1 P35372 1/20 0.50
OPRD1 P41143 1/20 0.50
TP53 P04637 1/20 0.49
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL11302341 0.85 ALDH1A1 (0.51) LMNAALDH1A1KMT2ATSHRMEN1
SCHEMBL4152007 0.83 ALDH1A1 (0.54) LMNAALDH1A1KMT2APOLBMEN1
SCHEMBL4159966 0.82 LMNA (0.49) LMNAALDH1A1KMT2ATSHRMEN1
SCHEMBL22619418 0.81 SMN1; SMN2 (0.50) LMNAALDH1A1KMT2ANPC1MEN1
SCHEMBL4161233 0.81 ALDH1A1 (0.61) LMNAALDH1A1KMT2ANPC1TSHR
SCHEMBL4068451 0.80 POLB (0.78) LMNACYP2C9ALDH1A1KMT2ATSHR
SCHEMBL4168948 0.79 KEAP1 (0.61) LMNACYP2C9ALDH1A1KMT2ATSHR
Hydrochloric Acid SCHEMBL27601325 0.79 TMPRSS6 (0.56) LMNACYP2C9ALDH1A1MAPK1KDM4E
SCHEMBL11511836 0.78 ALDH1A1 (0.83) LMNACYP2C9ALDH1A1KMT2ANPC1
SCHEMBL6949807 0.78 CYP2C9 (0.66) LMNACYP2C9ALDH1A1KMT2ANPC1

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-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CYCLACEL LIMITED (GB) 2009-05-28 US disclosed
EP-1756098-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS Cyclacel Limited (GB) 2007-02-28 EP disclosed
WO-2005116025-A2 2-SUBSTITUTED-4-HETEROARYL-PYRIMIDINES USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISORDERS CYCLACEL LIMITED (GB) 2005-12-08 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-20090137572-A1 2-substituted-4-heteroaryl-pyrimidines useful for the treatment of proliferative disorders CDK2, CDK4, CDK20 LMNA 1768/4885CYP2C9 4609/4885ALDH1A1 2743/4885

“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.