SCHEMBL3918342

SCHEMBL3918342

O/N=C/c1nccnc1Cl

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 3/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 2/20 0.33
FGF23 Q9GZV9 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3918346 1.00 PKM (0.35) PKMRAB9ASMN1; SMN2NPC1GAA
SCHEMBL3915967 0.73 FGF23 (0.40) RAB9ASMN1; SMN2NPC1GAAKDM4E
SCHEMBL3915965 0.73 FGF23 (0.40) RAB9ASMN1; SMN2NPC1GAAKDM4E
SCHEMBL376750 0.72 ALDH1A1 (0.31) KDM4EKMT2AALDH1A1L3MBTL1
SCHEMBL376749 0.72 ALDH1A1 (0.31) KDM4EKMT2AALDH1A1L3MBTL1
SCHEMBL5119679 0.72 NFE2L2 (0.45) FGF23ALDH1A1HPGD
SCHEMBL5015761 0.72 NFE2L2 (0.45) FGF23ALDH1A1HPGD
SCHEMBL5015762 0.72 NFE2L2 (0.45) FGF23ALDH1A1HPGD
SCHEMBL23457284 0.70
SCHEMBL570241 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869032-B8 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-03-25 EP disclosed
EP-1869032-B1 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2008-08-13 EP disclosed
US-20080167297-A1 Pyrimidine Derivatives for Use as Anticancer Agents ASTRAZENECA AB (SE) 2008-07-10 US disclosed
EP-1869032-A1 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS AstraZeneca AB (SE) 2007-12-26 EP disclosed
WO-2006106307-A1 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2006-10-12 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-20080167297-A1 Pyrimidine Derivatives for Use as Anticancer Agents IGF1R, TYMP, IGFBP1 PKM 2425/4885RAB9A 3435/4885SMN1; SMN2 2910/4885

“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.