SCHEMBL13339959

SCHEMBL13339959

Cc1nc(COC2CCCCO2)c(OC2CCCCO2)c(=O)n1C

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ P2RX3 P56373 7/20 0.31
▸ EP300 Q09472 1/20 0.30
▸ CREBBP Q92793 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ DHFR P00374 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
SCHEMBL3423023 0.80 PDE4B (0.30) —
SCHEMBL19299872 0.68 KDM4C (0.35) KDM4CNPC1RAB9AEP300CREBBP
SCHEMBL3522758 0.67 MEN1 (0.35) KDM4CNPC1RAB9AP2RX3EP300
SCHEMBL18834301 0.67 P2RX3 (0.40) P2RX3KMT2A
SCHEMBL9923393 0.65 KDM4C (0.37) KDM4CNPC1RAB9AMEN1KMT2A
SCHEMBL24967885 0.65 MEN1 (0.31) KDM4CNPC1RAB9AMEN1KMT2A
SCHEMBL19253491 0.64 KDM4C (0.34) KDM4CNPC1RAB9AEP300CREBBP
SCHEMBL17150168 0.64 KDM4E (0.43) KDM4CNPC1RAB9AEP300CREBBP
SCHEMBL24195847 0.64 KDM4C (0.39) KDM4CNPC1RAB9AP2RX3EP300
SCHEMBL21802183 0.63 MEN1 (0.39) RAB9AEP300CREBBPMEN1KMT2A

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
US-7718781-B2 Hydroxypyridonate and hydroxypyrimidinone chelating agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-05-18 — — US disclosed
US-7718781-B2 Hydroxypyridonate and hydroxypyrimidinone chelating agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-05-18 — — US disclosed
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