SCHEMBL5777769

SCHEMBL5777769

COc1cc(F)c(C2=NC(C)(C)CO2)c(C2CCCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR2B P41595 2/20 0.31
SIGMAR1 Q99720 2/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
CNR2 P34972 1/20 0.30

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
SCHEMBL5777628 0.96 LMNA (0.36) LMNAMAPTHTTHRH3KDM4E
SCHEMBL5772394 0.94 LMNA (0.37) LMNAMAPTHTTHRH3KDM4E
SCHEMBL5775964 0.90 LMNA (0.37) LMNAMAPTHTTKDM4EHTR2B
SCHEMBL5778345 0.84 LMNA (0.43) LMNAMAPTHTTHRH3KDM4E
SCHEMBL5777152 0.76 LMNA (0.38) LMNAMAPTHTTHRH3KDM4E
SCHEMBL610883 0.69 HTT (0.47) LMNAMAPTHTTHRH3KDM4E
SCHEMBL5776290 0.68 PTGDR2 (0.39) LMNAPTGDR2
SCHEMBL10768863 0.68 KDM4E (0.45) LMNAMAPTHTTHRH3KDM4E
SCHEMBL24718227 0.67 LMNA (0.46) LMNAMAPTHTTHRH3KDM4E
SCHEMBL30798594 0.67 LMNA (0.46) LMNAMAPTHTTHRH3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483257-B1 QUINAZOLINE COMPOUNDS USEFUL IN THERAPY PFIZER LTD (GB) 2006-09-13 EP disclosed
US-6936619-B2 Cardiovascular disorders; antilipemic agents; sexual disorders PFIZER, INC. (US) 2005-08-30 US disclosed
US-20040029859-A1 Compounds useful in therapy PFIZER INC. 2004-02-12 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-20040029859-A1 Compounds useful in therapy ADRA1D, HSD3B1, PTGER1 LMNA 945/4885MAPT 4800/4885HTT 2071/4885

“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.