SCHEMBL4187293

SCHEMBL4187293

CC(C)(C)C(Cc1ccc(Cl)c(Br)c1)NC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.38
CA1 P00915 6/20 0.38
CCKAR P32238 3/20 0.38
CCKBR P32239 3/20 0.38
FPR2 P25090 1/20 0.37
ITGB1 P05556 2/20 0.36
ITGA4 P13612 2/20 0.36
TACR1 P25103 1/20 0.36
CNR2 P34972 1/20 0.36
TSHR P16473 1/20 0.34
MME P08473 1/20 0.34
GRN P28799 1/20 0.34
SORT1 Q99523 1/20 0.34

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
SCHEMBL1869960 0.80 MME (0.51) FPR2MME
SCHEMBL3975272 0.80 MME (0.51) FPR2MME
SCHEMBL3974459 0.78 CTSB (0.49) FPR2
SCHEMBL1935741 0.77 MME (0.40) TSHRMME
SCHEMBL1935307 0.75 PPARG (0.42) TSHRMME
SCHEMBL5739824 0.74 ALDH1A1 (0.48)
SCHEMBL28679142 0.74 SLC7A5 (0.57)
SCHEMBL3751045 0.74 SLC7A5 (0.57)
SCHEMBL2881400 0.73 ACACB (0.46) CA2MME
SCHEMBL1156553 0.72 GRN (0.32) MMEGRNSORT1

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-20090239865-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES PFIZER PRODUCTS INC. 2009-09-24 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-20090239865-A1 DIBENZYL AMINE COMPOUNDS AND DERIVATIVES APOB, LDLR, CETP CA2 4881/4885CA1 4857/4885CCKAR 2809/4885

“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.