SCHEMBL2598616

SCHEMBL2598616

Cc1cc2cc(CNc3nc(N)ncc3Cc3ccc4[nH]ccc4c3)ccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.41
ABL1 P00519 1/20 0.41
SRC P12931 1/20 0.41
MAPT P10636 8/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
VCP P55072 1/20 0.39
NMT1 P30419 1/20 0.38
F2 P00734 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
ALOX12 P18054 1/20 0.36
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL16494108 0.94 ABL1 (0.40) LMNAABL1SRCMAPTALDH1A1
SCHEMBL2598501 0.87 EGFR (0.45) VCP
SCHEMBL2598814 0.87 BACE1 (0.40) LMNAABL1SRCTDP1NMT1
SCHEMBL16494484 0.87 LMNA (0.40) LMNAABL1SRCTDP1NMT1
SCHEMBL2598738 0.86 LMNA (0.41) LMNAMAPTALDH1A1KDM4ETDP1
SCHEMBL16494955 0.85 LMNA (0.40) LMNAMAPTALDH1A1KDM4ETDP1
SCHEMBL14839724 0.85 VCP (0.42) LMNAABL1SRCMAPTALDH1A1
SCHEMBL2598674 0.84 CLK1 (0.40) LMNAABL1SRCMAPTALDH1A1
SCHEMBL14840075 0.83 LMNA (0.38) LMNAABL1SRCTDP1NMT1
SCHEMBL2598704 0.83 PRKCQ (0.39) LMNAABL1SRCTDP1NMT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2395001-A1 Novel pyrimidine derivatives Chemilia AB (SE) 2011-12-14 EP claimed
EP-2571867-B1 NOVEL PYRIMIDINE DERIVATIVES NOVIGA RES AB (SE) 2015-11-04 EP disclosed
US-8927547-B2 Pyrimidine derivatives NOVIGA RESEARCH AB (SE) 2015-01-06 US disclosed
US-20130089518-A1 NOVEL PYRIMIDINE DERIVATIVES CHEMILIA AB (SE) 2013-04-11 US disclosed
EP-2571867-A1 NOVEL PYRIMIDINE DERIVATIVES Chemilia AB (SE) 2013-03-27 EP disclosed
EP-2395001-A1 Novel pyrimidine derivatives Chemilia AB (SE) 2011-12-14 EP disclosed
WO-2011144742-A1 NOVEL PYRIMIDINE DERIVATIVES CHEMILIA AB (SE) 2011-11-24 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-20130089518-A1 NOVEL PYRIMIDINE DERIVATIVES DPYD, TYMS, TYMP LMNA 1428/4885ABL1 2100/4885SRC 3727/4885

“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.