SCHEMBL25426994

SCHEMBL25426994

COc1cccc(CN(Cc2ccc(-n3cccn3)cc2)c2ccc(OCCOCCOc3cccc(OC)c3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGER2 P43116 2/20 0.43
▸ QPCT Q16769 2/20 0.42
▸ SLC2A1 P11166 5/20 0.41
▸ SLC2A4 P14672 3/20 0.40
▸ SLC2A8 Q9NY64 1/20 0.40
▸ DGAT2 Q96PD7 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GHSR Q92847 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37

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
SCHEMBL25424800 0.94 PTGER2 (0.44) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL25298286 0.93 PTGER2 (0.41) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL25425398 0.91 PTGER2 (0.42) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL30245811 0.91 PTGER2 (0.42) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL25424367 0.89 PTGER2 (0.41) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL25427150 0.88 PTGER2 (0.43) PTGER2SLC2A1SLC2A4SLC2A8DGAT2
SCHEMBL25424546 0.88 PTGER2 (0.40) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL30245444 0.88 PTGER2 (0.40) PTGER2QPCTSLC2A1SLC2A4SLC2A8
SCHEMBL25425531 0.88 QPCT (0.41) PTGER2QPCTSLC2A1SLC2A4DGAT2
SCHEMBL25425923 0.88 PTGER2 (0.43) PTGER2QPCTSLC2A1SLC2A4SLC2A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384516-A1 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS Texas Heart Institute (US) 2024-06-19 — — EP claimed
WO-2023018472-A9 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-07-13 — — WO claimed
WO-2023018472-A1 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-02-16 — — WO claimed
EP-4384516-A1 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS Texas Heart Institute (US) 2024-06-19 — — EP disclosed
WO-2023018472-A9 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-07-13 — — WO disclosed
WO-2023018472-A1 AMINOARYL-INTEGRIN AGONISTS COMPOUNDS TEXAS HEART INSTITUTE (US) 2023-02-16 — — WO disclosed
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