SCHEMBL6803906

SCHEMBL6803906

CC(C)c1cccc(C(C)C)c1NC(=O)N(Cc1ccc(O)cc1)CC1(c2cncn2C(c2ccccc2)(c2ccccc2)c2ccccc2)CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 2/20 0.37
SOAT1 P35610 2/20 0.37
UBE2M P61081 1/20 0.36
DCUN1D1 Q96GG9 1/20 0.36
ACAT1 P24752 1/20 0.35
TRPV1 Q8NER1 2/20 0.35
NMBR P28336 5/20 0.34
EGFR P00533 3/20 0.33
ERBB2 P04626 3/20 0.33

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
SCHEMBL6182575 0.81 SOAT1 (0.42) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6186309 0.78 NMBR (0.51) SOAT2SOAT1ACAT1NMBR
SCHEMBL6184387 0.78 SOAT1 (0.38) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6803908 0.78 UBE2M (0.39) SOAT2SOAT1UBE2MDCUN1D1NMBR
SCHEMBL6184255 0.78 SOAT1 (0.42) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6183404 0.78 LPAR1 (0.42) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6184687 0.76 SOAT1 (0.38) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6184564 0.76 SOAT1 (0.41) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL6202938 0.76 SOAT1 (0.40) SOAT2SOAT1UBE2MDCUN1D1ACAT1
SCHEMBL9765050 0.75 SOAT1 (0.51) SOAT2SOAT1UBE2MDCUN1D1ACAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 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-20040063643-A1 Bombesin antagonists BRS3, NPSR1, GNRHR SOAT2 3379/4885SOAT1 3334/4885UBE2M 3897/4885

“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.