SCHEMBL6185313

SCHEMBL6185313

CCOC(=O)C1(CN(Cc2ccc(O)cc2)C(=O)Nc2c(C(C)C)cccc2C(C)C)CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 2/20 0.41
SOAT1 P35610 3/20 0.40
SOAT2 O75908 2/20 0.40
UBE2M P61081 1/20 0.38
DCUN1D1 Q96GG9 1/20 0.38
ACAT1 P24752 1/20 0.38
LMNA P02545 1/20 0.38
EGFR P00533 1/20 0.37
ERBB2 P04626 1/20 0.37
MAPK1 P28482 1/20 0.36
P4HB P07237 1/20 0.36
KMT2A Q03164 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
SCHEMBL6798348 0.82 SOAT1 (0.40) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6184255 0.80 SOAT1 (0.42) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6182575 0.80 SOAT1 (0.42) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6183404 0.79 LPAR1 (0.42) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6202938 0.78 SOAT1 (0.40) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6183730 0.78 SOAT1 (0.42) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6186309 0.78 NMBR (0.51) SOAT1SOAT2ACAT1
SCHEMBL6807653 0.77 SOAT1 (0.43) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6184564 0.77 SOAT1 (0.41) SOAT1SOAT2UBE2MDCUN1D1ACAT1
SCHEMBL6803816 0.77 SOAT1 (0.49) SOAT1SOAT2ACAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501800-A1 BOMBESIN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-02-02 EP claimed
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 US claimed
WO-2003092670-A1 BOMBESIN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2003-11-13 WO claimed
EP-1501800-A1 BOMBESIN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-02-02 EP disclosed
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 US disclosed
WO-2003092670-A1 BOMBESIN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2003-11-13 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-20040063643-A1 Bombesin antagonists BRS3, NPSR1, GNRHR NLRP3 881/4885SOAT1 3334/4885SOAT2 3379/4885

“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.