SCHEMBL3790645

SCHEMBL3790645

C=C(C)C(=O)NC[C]=O

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
SCHEMBL1679408 0.85 TGFBR1 (0.32)
SCHEMBL245262 0.78
SCHEMBL3914177 0.78
SCHEMBL316224 0.76 TGFBR1 (0.41)
SCHEMBL59411 0.76 TGFBR1 (0.41)
SCHEMBL28198248 0.75 TGFBR1 (0.38)
SCHEMBL809628 0.74
SCHEMBL14949 0.74
SCHEMBL27050 0.74
SCHEMBL2316848 0.74

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1675252-A Macromer forming catalysts JOHNSON & JOHNSON VISION CARE (US) 2005-09-28 CN claimed
US-20050107543-A1 Fluoro linkers and their use as linkers for enzyme-activated drug conjugates PFIZER INC. 2005-05-19 US claimed
CN-1154512-C polymeric derivatives of camptothecin �������Ŷ���Լ��������˾ 2004-06-23 CN claimed
EP-1414792-A1 FLUORO LINKERS AND THEIR USE AS LINKERS FOR ENZYME-ACTIVATED DRUG CONJUGATES Pharmacia Italia S.p.A. (IT) 2004-05-06 EP claimed
EP-1019090-B1 POLYMERIC DERIVATIVES OF CAMPTOTHECINS PHARMACIA ITALIA SPA (IT) 2004-02-18 EP claimed
US-20030195152-A1 Polymeric conjugates of antitumor agents PHARMACIA ITALIA, S.P.A. (IT) 2003-10-16 US claimed
EP-1317287-A2 POLYMERIC CONJUGATES OF ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2003-06-11 EP claimed
WO-2003014069-A1 FLUORO LINKERS AND THEIR USE AS LINKERS FOR ENZYME-ACTIVATED DRUG CONJUGATES PHARMACIA ITALIA SPA (IT) 2003-02-20 WO claimed
US-6376617-B1 ANTITUMOR AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-04-23 US claimed
US-20020032331-A1 BIOACTIVE DERIVATIVES OF CAMPTOTHECIN PHARMACIA ITALIA S.P.A. (IT) 2002-03-14 US claimed
WO-2002007770-A2 POLYMERIC CONJUGATES OF ANTITUMOR AGENTS PHARMACIA ITALIA S.P.A. (IT) 2002-01-31 WO claimed
US-6328953-B1 AS ANTITUMOR AGENT AND REDUCED TOXICITY PHARMACIA & UPJOHN S.P.A. (IT) 2001-12-11 US claimed
CN-1272796-A polymeric derivatives of camptothecin PHARMACIA & UPJOHN SPA (IT) 2000-11-08 CN claimed
EP-1019090-A1 POLYMERIC DERIVATIVES OF CAMPTOTHECINS PHARMACIA &amp; UPJOHN S.p.A. (IT) 2000-07-19 EP claimed
EP-0944400-A1 BIOACTIVE DERIVATIVES OF CAMPTOTHECIN PHARMACIA &amp; UPJOHN S.p.A. (IT) 1999-09-29 EP claimed
WO-1999017804-A1 POLYMERIC DERIVATIVES OF CAMPTOTHECINS PHARMACIA & UPJOHN S.P.A. (IT) 1999-04-15 WO claimed
WO-1999017805-A1 BIOACTIVE DERIVATIVES OF CAMPTOTHECIN PHARMACIA & UPJOHN S.P.A. (IT) 1999-04-15 WO claimed
US-7812051-B2 Pharmaceutical compositions of β-lapachone and β-lapachone analogs with improved tumor targeting potential ARQULE, INC. (US) 2010-10-12 US disclosed
EP-0649312-A1 ANTHRACYCLINE CONJUGATES, THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA &amp; UPJOHN S.p.A. (IT) 1995-04-26 EP disclosed
WO-1995010552-A1 ACRYLAMIDO FUNCTIONAL DISUBSTITUTED ACETYL ARYL KETONE PHOTOINITIATORS LOWELL ENGINEERING CORPORATION (US) 1995-04-20 WO disclosed