SCHEMBL7745422

SCHEMBL7745422

COc1c(Cl)cc(CC(N)C(=O)O)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 5/20 0.51
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ TTR P02766 2/20 0.49
▸ ADORA3 P0DMS8 2/20 0.49
▸ THRB P10828 2/20 0.49
▸ PDE4D Q08499 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ NR3C1 P04150 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ HTR1A P08908 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ TBXA2R P21731 1/20 0.49
▸ NTSR1 P30989 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49

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
SCHEMBL7745425 1.00 SLC7A5 (0.51) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL15085708 0.91 SLC7A5 (0.47) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL28087654 0.91 SLC7A5 (0.47) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL2674679 0.82 SLC7A5 (0.52) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL29510634 0.82 SLC7A5 (0.58) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL7280620 0.82 THRB (0.56) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL2931777 0.82 SLC7A5 (0.52) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL2674665 0.82 SLC7A5 (0.52) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL2674668 0.82 SLC7A5 (0.52) SLC7A5MEN1KMT2AHSD17B10LMNA
SCHEMBL15085689 0.82 MEN1 (0.48) SLC7A5MEN1KMT2AHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0735819-B1 CRYPTOPHYCINS UNIV HAWAII (US) 2001-07-11 — — EP disclosed
EP-0830136-A4 NEW CRYPTOPHYCINS FROM SYNTHESIS UNIV HAWAII (US) 2001-01-24 — — EP disclosed
EP-0836382-A4 NEW CRYPTOPHYCINS UNIV HAWAII (US) 2001-01-17 — — EP disclosed
US-6013626-A TO INHIBIT THE PROLIFERATION OF MAMMALIAN CELLS; ANTITUMOR AGENTS THE UNIVERSITY OF HAWAII (US) 2000-01-11 — — US disclosed
US-5955423-A USED TO INHIBIT THE PROLIFERATION OF HYPERPROLIFERATIVE CELLS; DERIVED FROM NOSTOC SP.OF BLUE-GREEN ALGAE THE UNIVERSITY OF HAWAII (US) 1999-09-21 — — US disclosed
US-5952298-A NOVEL CRYPTOPHYCIN COMPOUNDS PRODUCED BY CYANOBACTERIA OF GENUS NOSTOC USED AS ANTIPROLIFERATIVE AGENTS IN COMBINATION WITH ANTIMITOTIC AGENTS TO TREAT CELLS WITH DRUG RESISTANT PHENOTYPES, AND TO TREAT NEOPLASIA THE UNIVERSITY OF HAWAII (US) 1999-09-14 — — US disclosed
EP-0836382-A1 NEW CRYPTOPHYCINS UNIVERSITY OF HAWAII (US) 1998-04-22 — — EP disclosed
EP-0830136-A1 NEW CRYPTOPHYCINS FROM SYNTHESIS UNIVERSITY OF HAWAII (US) 1998-03-25 — — EP disclosed
EP-0735819-A4 NEW CRYPTOPHYCINS UNIV HAWAII (US) 1997-03-19 — — EP disclosed
WO-1996039829-A9 NEW CRYPTOPHYCINS — 1997-02-20 — — WO disclosed
WO-1996040184-A1 NEW CRYPTOPHYCINS FROM SYNTHESIS UNIVERSITY OF HAWAII (US) 1996-12-19 — — WO disclosed
WO-1996039829-A1 NEW CRYPTOPHYCINS UNIVERSITY OF HAWAII (US) 1996-12-19 — — WO disclosed
EP-0735819-A1 NEW CRYPTOPHYCINS UNIVERSITY OF HAWAII (US) 1996-10-09 — — EP disclosed
WO-1995017093-A1 NEW CRYPTOPHYCINS UNIVERSITY OF HAWAII (US) 1995-06-29 — — WO disclosed
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