SCHEMBL31065364

SCHEMBL31065364

CC1(C)OCC(C(F)CO)O1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 2/20 0.31
▸ MMP9 P14780 3/20 0.30
▸ MMP1 P03956 2/20 0.30
▸ MMP2 P08253 2/20 0.30
▸ MMP3 P08254 1/20 0.30
▸ MMP7 P09237 1/20 0.30
▸ MMP8 P22894 1/20 0.30
▸ MMP13 P45452 1/20 0.30

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
SCHEMBL11027021 1.00 CA2 (0.31) CA2MMP9MMP1MMP2MMP3
SCHEMBL10920720 0.81 CA2 (0.31) CA2
SCHEMBL12540514 0.78 CA2 (0.32) CA2MMP9MMP1MMP2MMP3
SCHEMBL14107378 0.78 CA2 (0.32) CA2MMP9MMP1MMP2MMP3
SCHEMBL8910610 0.78 CA2 (0.32) CA2
SCHEMBL16371103 0.78 CA2 (0.32) CA2
SCHEMBL4248034 0.78 CA2 (0.32) CA2
SCHEMBL11961355 0.78 CA2 (0.32) CA2
SCHEMBL4248027 0.78 CA2 (0.32) CA2
SCHEMBL12121595 0.78 CA2 (0.32) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4602044-A1 SUBSTITUTED 3,7-DIHYDRO-1 H-PURINE-2,6-DIONES AND USE THEREOF invIOs GmbH (AT) 2025-08-20 — — EP disclosed
WO-2024133605-A1 SUBSTITUTED 3,7-DIHYDRO-1 H-PURINE-2,6-DIONES AND USE THEREOF INVIOS GMBH (AT) 2024-06-27 — — WO disclosed
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