SCHEMBL10063370

SCHEMBL10063370

CCC(C)(CC(C)(CC(C)(C)C(=O)NCCCNC(=O)C(CCOC=O)NC(=O)C1(O)CC(O)C(O)C(O)C1)C(=O)NCC(C)O)C(=O)NCCCNC(=S)Nc1ccc(C2=C3C=CC(=O)C=C3OC3C=C(O)C=CC23)c(C(=O)O)c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL16093127 0.83 FKBP1A (0.30) —
SCHEMBL16522843 0.81 — —
SCHEMBL10063379 0.77 — —
SCHEMBL10063376 0.77 — —
SCHEMBL16522851 0.75 — —
SCHEMBL14999650 0.73 — —
SCHEMBL10063371 0.71 — —
SCHEMBL15004023 0.70 KDM4C (0.37) —
SCHEMBL12518496 0.70 KDM4C (0.40) —
SCHEMBL10063378 0.68 KDM4C (0.35) —

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
US-9867884-B2 Vascular delivery systems BEN-GURION UNIVERSITY OF NEGEV RESEARCH & DEVELOPMENT AUTHORITY (IL) 2018-01-16 — — US disclosed
US-20150056157-A1 VASCULAR DELIVERY SYSTEMS BEN-GURION UNIVERSITY OF NEGEV RESEARCH & DEVELOPMENT AUTHORITY (IL) 2015-02-26 — — US disclosed
US-8840874-B2 Vascular delivery systems BEN-GURION UNIVERSITY OF THE NEGEV RESEARCH AND DEVELOPMENT AUTHORITY (IL) 2014-09-23 — — US disclosed
US-20120014904-A1 VASCULAR DELIVERY SYSTEMS BEN-GURION UNIVERSITY OF THE NEGEV RESEARCH AND DEVELOPMENT AUTHORITY (IL) 2012-01-19 — — US disclosed
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