SCHEMBL5559149

SCHEMBL5559149

COc1ccc(Cc2ccccc2CC(C)C)cc1Cc1cccc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.47
CETP P11597 1/20 0.46
SMPD1 P17405 1/20 0.46
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE10A Q9Y233 1/20 0.41
CNR2 P34972 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
SCHEMBL5554103 0.83 BCL2L1 (0.67) BCL2L1ALDH1A1KDM4EL3MBTL1
SCHEMBL5559016 0.82 BCL2L1 (0.53) BCL2L1CETPSMPD1ALDH1A1LMNA
SCHEMBL5560532 0.79 CETP (0.43) BCL2L1CETPSMPD1ALDH1A1LMNA
SCHEMBL5554648 0.78 CYP2C9 (0.46) BCL2L1CETPALDH1A1LMNAKDM4E
SCHEMBL4652440 0.78 BCL2L1 (0.58) BCL2L1CETPSMPD1ALDH1A1LMNA
SCHEMBL4651677 0.78 BCL2L1 (0.58) BCL2L1CETPSMPD1ALDH1A1LMNA
SCHEMBL25798826 0.75 CETP (0.59) CETPALDH1A1LMNAMAPK1KDM4E
SCHEMBL4652272 0.75 BCL2L1 (0.62) BCL2L1CETPSMPD1ALDH1A1LMNA
SCHEMBL4652385 0.75 CETP (0.53) CETPSMPD1ALDH1A1LMNAMAPK1
SCHEMBL17805815 0.74 BCL2L1 (0.84) BCL2L1SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1594512-A4 COMPOUNDS FOR THE TREATMENT OF VIRAL INFECTION KEMIA INC (US) 2007-07-11 EP disclosed
EP-1594512-A2 COMPOUNDS FOR THE TREATMENT OF VIRAL INFECTION Kemia, INC. (US) 2005-11-16 EP disclosed
US-20040248850-A1 Compounds for the treatment of HIV infection KEMIA, INC. 2004-12-09 US disclosed
WO-2004071426-A2 COMPOUNDS FOR THE TREATMENT OF VIRAL INFECTION KEMIA INC. (US) 2004-08-26 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-20040248850-A1 Compounds for the treatment of HIV infection CCR5, CD4, HAVCR2 BCL2L1 2807/4885CETP 322/4885SMPD1 614/4885

“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.