SCHEMBL7865177

SCHEMBL7865177

O=C(c1ccccc1)c1ccccc1COCc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ AKR1C3 P42330 1/20 0.53
▸ GAA P10253 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ CYP19A1 P11511 1/20 0.49
▸ ALDH1A1 P00352 5/20 0.48
▸ CYP1A2 P05177 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ USP2 O75604 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KEAP1 Q14145 1/20 0.46
▸ NFE2L2 Q16236 1/20 0.46
▸ LIG1 P18858 1/20 0.44
▸ ELANE P08246 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ PGR P06401 1/20 0.44

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
SCHEMBL4622029 0.91 L3MBTL1 (0.50) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL9358998 0.90 L3MBTL1 (0.52) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL4729690 0.89 L3MBTL1 (0.51) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL24834273 0.85 CYP3A4 (0.46) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL1558507 0.85 L3MBTL1 (0.51) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL27482417 0.84 PTPRC (0.54) L3MBTL1AKR1C3GAAMAPTALDH1A1
SCHEMBL11036287 0.84 AKR1C3 (0.61) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL6666740 0.82 L3MBTL1 (0.49) L3MBTL1AKR1C3GAAMAPTCYP19A1
SCHEMBL23453516 0.82 TP53 (0.59) GAAMAPTALDH1A1CYP2C9KMT2A
SCHEMBL28423359 0.82 AKR1C3 (0.59) L3MBTL1AKR1C3GAAMAPTCYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6284910-B1 FARNESYL TRANSFERASE INHIBITORS UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2001-09-04 — — US disclosed
EP-1069916-A2 LATENT REACTIVE BLOOD COMPATIBLE AGENTS SurModics, Inc. (US) 2001-01-24 — — EP disclosed
EP-0585436-B1 IMMOBILIZATION OF CHEMICAL SPECIES IN CROSSLINKED MATRICES SURMODICS INC (US) 2000-05-03 — — EP disclosed
WO-1999047176-A2 LATENT REACTIVE BLOOD COMPATIBLE AGENTS SURMODICS, INC. (US) 1999-09-23 — — WO disclosed
US-5563056-A FORMING A MATRIX HAVING FIRST CHEMICAL SPECIES COVALENTLY IMMOBILIZED AND INCLUDES FREE MOLECULES OF SECOND CHEMICAL SPECIES, GRADUALLY RELEASING THE SECOND SPECIES MOLECULE FROM MATRIX BSI CORPORATION (US) 1996-10-08 — — US disclosed
EP-0585436-A4 — — 1994-03-30 — — EP disclosed
EP-0585436-A1 IMMOBILIZATION OF CHEMICAL SPECIES IN CROSSLINKED MATRICES BIO-METRIC SYSTEMS, INC. (US) 1994-03-09 — — EP disclosed
WO-1993016176-A1 IMMOBILIZATION OF CHEMICAL SPECIES IN CROSSLINKED MATRICES BIO-METRIC SYSTEMS, INC. (US) 1993-08-19 — — WO disclosed
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