SCHEMBL7239095

SCHEMBL7239095

CC(=O)Nc1ccc(C2(Cl)c3ccc([nH]3)C(C3=CN(C)CC=C3)=C3C=CC(=N3)C(C3=CN(C)CC=C3)=c3ccc([nH]3)=C(C3=CN(C)CC=C3)C3=NC2(Cl)C=C3)cc1

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
SCHEMBL7238996 0.89 — —
SCHEMBL8184161 0.76 — —
SCHEMBL8187363 0.75 — —
SCHEMBL3903690 0.72 — —
SCHEMBL9405181 0.69 — —
SCHEMBL8182556 0.69 — —
Chloromethane SCHEMBL3670008 0.69 — —
SCHEMBL8183373 0.68 — —
SCHEMBL5947696 0.68 — —
SCHEMBL7149929 0.67 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-06-05 — — US claimed
WO-2002078695-A1 THIAPORPHYRIN, SELENAPORPHYRIN, AND CAROTENOID PORPHYRIN COMPOUNDS AS C-MYC AND TELOMERASE INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-10-10 — — WO claimed
US-20030105130-A1 Thiaporphyrin, selenaporphyrin, and carotenoid porphyrin compounds as c-myc and telomerase inhibitors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-06-05 — — US disclosed
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