SCHEMBL6983394

SCHEMBL6983394

NC(=O)Nc1ccc(C(Oc2ccccc2)C(=O)O)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.44
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ F2 P00734 1/20 0.42
▸ F10 P00742 1/20 0.42
▸ PRSS1 P07477 1/20 0.42
▸ PPARA Q07869 3/20 0.39
▸ STK39 Q9UEW8 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL6982573 0.84 F10 (0.45) PPARGNPC1RAB9AL3MBTL1F2
SCHEMBL6973224 0.84 PPARA (0.43) PPARGPPARACYP1A2KMT2AALDH1A1
SCHEMBL6978533 0.84 MEN1 (0.46) PPARGNPC1RAB9AL3MBTL1F2
SCHEMBL6979803 0.81 PPARG (0.45) PPARGL3MBTL1PPARAKMT2AGAA
SCHEMBL11752505 0.74 PPARG (0.67) PPARGPPARAMEN1KMT2A
SCHEMBL14889080 0.74 PPARG (0.67) PPARGPPARAMEN1KMT2A
SCHEMBL1565657 0.72 PPARG (0.51) PPARGPPARAKDM4EALDH1A1
SCHEMBL3763319 0.72 KDM4E (0.51) PPARGPPARAKDM4EALDH1A1
SCHEMBL11711586 0.72 PPARG (0.57) PPARGRAB9APPARAMEN1KMT2A
SCHEMBL6982722 0.72 KEAP1 (0.45) PPARGNPC1RAB9AF10PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1030835-B1 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS ASTRAZENECA UK LTD (GB) 2003-01-22 — — EP disclosed
US-6344570-B1 ANTISTICKING AGENTS FOR CELLS ASTRAZENECA UK LIMITED (GB) 2002-02-05 — — US disclosed
EP-1030835-A2 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS AstraZeneca UK Limited (GB) 2000-08-30 — — EP disclosed
WO-1999024398-A2 UREA DERIVATIVES AND THEIR USE AS INTEGRIN INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-05-20 — — WO disclosed
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