SCHEMBL6587652

SCHEMBL6587652

CC1CC(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cc(C(F)(F)F)ccc2N1C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.47
▸ BRD2 P25440 1/20 0.47
▸ BRD3 Q15059 1/20 0.47
▸ PTGDR2 Q9Y5Y4 1/20 0.46
▸ CETP P11597 12/20 0.46

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
SCHEMBL6587647 1.00 BRD4 (0.47) BRD4BRD2BRD3PTGDR2CETP
SCHEMBL6588253 0.90 CETP (0.55) BRD4BRD2BRD3CETP
SCHEMBL1903767 0.90 CETP (0.55) BRD4BRD2BRD3CETP
SCHEMBL1899816 0.88 CETP (0.49) BRD4BRD2BRD3CETP
SCHEMBL1899531 0.85 CETP (0.59) CETP
SCHEMBL7820687 0.85 CETP (0.59) CETP
SCHEMBL5413690 0.81 PTGDR2 (0.60) PTGDR2
SCHEMBL5402943 0.81 PTGDR2 (0.60) PTGDR2
SCHEMBL5413692 0.81 PTGDR2 (0.60) PTGDR2
SCHEMBL5402933 0.81 PTGDR2 (0.60) PTGDR2

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-1114033-B1 4-CARBOXYAMINO-2-METHYL-1,2,3,4-TETRAHYDROQUINOLINES AS CETP INHIBITORS PFIZER PROD INC (US) 2004-09-29 — — EP disclosed
US-6395751-B1 SYNERGISTIC MIXTURE; ANTICHOLESTEROL AGENTS PFIZER INC. 2002-05-28 — — US disclosed
US-6147090-A CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS USED TO TREAT DISEASES WHICH ARE EXACERBATED BY LOW LEVELS OF HDL CHOLESTEROL AND/OR HIGH LEVELS OF LDL-CHOLESTEROL AND TRIGLYCERIDES, SUCH AS ATHEROSCLEROSIS AND CARDIOVASCULAR PFIZER INC. (US) 2000-11-14 — — US disclosed
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