SCHEMBL5455961

SCHEMBL5455961

CCc1c(C)nc(N2CCC(O)C2)nc1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KDM4E B2RXH2 4/20 0.35
HSD17B10 Q99714 2/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE10A Q9Y233 1/20 0.35
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
MCHR1 Q99705 1/20 0.34
MAPT P10636 1/20 0.34
NAPEPLD Q6IQ20 4/20 0.33
CDK1 P06493 1/20 0.33

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
SCHEMBL5462475 0.92 KDM4E (0.40) HCRTR1HCRTR2LMNASMN1; SMN2KDM4E
SCHEMBL5450960 0.79 HRH4 (0.42) SMN1; SMN2KDM4EALDH1A1HTTMCHR1
SCHEMBL5452783 0.77 NUDT1 (0.51) LMNASMN1; SMN2KDM4EHSD17B10HPGD
SCHEMBL5444088 0.74 CRHR1 (0.37) HCRTR1HCRTR2SMN1; SMN2ALDH1A1MEN1
SCHEMBL5448462 0.73 TSHR (0.37) P2RY12HCRTR1HCRTR2LMNASMN1; SMN2
SCHEMBL5452827 0.73 NUDT1 (0.47) LMNASMN1; SMN2KDM4EHSD17B10HPGD
SCHEMBL16896324 0.70 IKBKB (0.35) P2RY12LMNASMN1; SMN2KDM4EHSD17B10
SCHEMBL18243919 0.70 IKBKB (0.35) P2RY12LMNASMN1; SMN2KDM4EHSD17B10
SCHEMBL27680972 0.69 RBP4 (0.54) KDM4EHSD17B10USP2HPGDNPSR1
SCHEMBL27379669 0.65 METAP2 (0.37) PDE10AMCHR1METAP2SLC6A3

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-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ASTRAZENECA AB (SE) 2007-11-08 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-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ARAF, BRAF, RAF1 P2RY12 2370/4885HCRTR1 4474/4885HCRTR2 4637/4885

“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.