SCHEMBL4163334

SCHEMBL4163334

CCOC(=O)Cn1c(=O)[nH]cc(I)c1=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
GSK3A P49840 2/20 0.46
GSK3B P49841 2/20 0.46
KDM4E B2RXH2 6/20 0.45
RAB9A P51151 1/20 0.43
SLC9A1 P19634 1/20 0.42
APOBEC3A P31941 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
PIN1 Q13526 1/20 0.40
PIN4 Q9Y237 1/20 0.40
POLB P06746 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 2/20 0.39

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
SCHEMBL7641949 0.85 SLC9A1 (0.57) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL8819921 0.76 ALDH1A1 (0.44) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL4174300 0.73 ALDH1A1 (0.47) ALDH1A1KDM4ERAB9ACYP1A2CYP2C9
SCHEMBL7082273 0.73 ALDH1A1 (0.49) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL8819789 0.72 ALDH1A1 (0.40) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL28828879 0.71 TSHR (0.50) ALDH1A1KDM4ERAB9ACYP1A2CYP2C9
SCHEMBL7643580 0.71 SLC9A1 (0.58) ALDH1A1KDM4ERAB9ASLC9A1
SCHEMBL10048132 0.70 GABRA1 (0.47) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL12709665 0.69 ALDH1A1 (0.60) ALDH1A1GSK3AGSK3BKDM4ERAB9A
SCHEMBL9089847 0.69 ALDH1A1 (0.50) ALDH1A1GSK3AGSK3BKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149485-A1 PYRIMIDINEDIONES AS TYROSINE KINASE INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2009-06-11 US disclosed
WO-2007122634-A2 PYRIMIDINEDIONES AS TYROSINE KINASE INHIBITORS JUBILANT BIOSYS LIMITED (IN) 2007-11-01 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-20090149485-A1 PYRIMIDINEDIONES AS TYROSINE KINASE INHIBITORS TK1, LCK, FYN ALDH1A1 1813/4885GSK3A 195/4885GSK3B 170/4885

“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.