SCHEMBL4714331

SCHEMBL4714331

CCOC(=O)C=Cc1cnc(SC)nc1Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.53
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
MAPT P10636 4/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
EGFR P00533 2/20 0.46
BTK Q06187 2/20 0.46
TDP1 Q9NUW8 2/20 0.45
POLB P06746 1/20 0.45
JAK3 P52333 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
PPARG P37231 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
MEN1 O00255 2/20 0.41

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
SCHEMBL7795043 0.89 SYK (0.53) SYKMAPK1HTTMAPTLMNA
SCHEMBL4714245 0.84 ALDH1A1 (0.46) SYKMAPK1HTTMAPTLMNA
SCHEMBL10192488 0.84 ALDH1A1 (0.46) SYKMAPK1HTTMAPTLMNA
SCHEMBL4713624 0.83 ALDH1A1 (0.48) SYKMAPK1HTTMAPTLMNA
SCHEMBL8373632 0.81 ALDH1A1 (0.52) SYKMAPK1HTTMAPTLMNA
SCHEMBL4716154 0.80 EGFR (0.53) SYKMAPTEGFRBTKJAK3
SCHEMBL4716152 0.80 EGFR (0.53) SYKMAPTEGFRBTKJAK3
SCHEMBL1313596 0.80 SYK (0.79) SYKMAPK1HTTMAPTLMNA
SCHEMBL4711389 0.79 ALDH1A1 (0.43) SYKMAPK1HTTMAPTLMNA
SCHEMBL4715139 0.79 ALDH1A1 (0.43) SYKMAPK1HTTMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964864-B1 PYRIDO 2,3-D PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2008-04-09 EP disclosed
EP-1806348-A2 Pyrido (2,3-D)Pyrimidines as inhibitors of cellular proliferation Warner-Lambert Company LLC (US) 2007-07-11 EP disclosed
US-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease BOOTH RICHARD JOHN (US) 2004-11-11 US disclosed
US-6498163-B1 POTENT INHIBITORS OF CYCLIN-DEPENDENT KINASES AND GROWTH FACTOR MEDIATED KINASES; CANCER, RESTENOSIS, ATHEROSCLEROSIS WARNER-LAMBERT COMPANY 2002-12-24 US disclosed
EP-1255755-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2002-11-13 EP disclosed
WO-2001055148-A1 PYRIDOPYRIMIDINONE DERIVATIVES FOR TREATMENT OF NEURODEGENERATIVE DISEASE WARNER-LAMBERT COMPANY (US) 2001-08-02 WO disclosed
EP-0964864-A2 PYRIDO 2,3-D] PYRIMIDINES AND 4-AMINOPYRIMIDINES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-12-22 EP disclosed
WO-1998033798-A2 PYRIDO[2,3-D]PYRIMIDINES AND 4-AMINO-PYRIMIDINES AS INHIBITORS OF CELL PROLIFERATION WARNER LAMBERT COMPANY (US) 1998-08-06 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-20040224958-A1 Pyridopyrimidinone derivatives for treatment of neurodegenerative disease CDK4, CDKL1, CCNT1 SYK 2342/4885MAPK1 158/4885HTT 1933/4885

“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.