SCHEMBL723880

SCHEMBL723880

CCC(N=C=N)N(C)C.O=C1CCC(=O)N1O

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
SCHEMBL490833 0.82
Hydrochloric Acid SCHEMBL20395920 0.81
SCHEMBL301679 0.78
Hydrochloric Acid SCHEMBL560373 0.76
SCHEMBL252711 0.70
Carbimide SCHEMBL3149105 0.68 KDM4E (0.30)
Propane SCHEMBL28183675 0.68 LMNA (0.33)
SCHEMBL4362792 0.67 CYP1A2 (0.38)
Alcohol SCHEMBL20856433 0.66 ALDH1A1 (0.33)
SCHEMBL6689112 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106163531-B Use of composition comprising surface-modified chondrocyte-derived extracellular matrix membrane as active ingredient for preventing adhesion 亚洲大学校产学协力团 2019-12-13 CN claimed
US-11913030-B2 Method of preparing mimicking angiogenic co-spheroids and application thereof NATIONAL TAIWAN UNIVERSITY (TW) 2024-02-27 US disclosed
CN-112154153-A Interleukin-2/interleukin-2 receptor alpha fusion proteins and methods of use 百时美施贵宝公司 2020-12-29 CN disclosed
CN-111094341-A Antibodies having functional domains in the elbow region between the variable and constant domains 生物医学研究院 2020-05-01 CN disclosed
US-20200071678-A1 METHOD OF PREPARING MIMICKING ANGIOGENIC CO-SPHEROIDS AND APPLICATION THEREOF NATIONAL TAIWAN UNIVERSITY (TW) 2020-03-05 US disclosed
US-10449269-B2 Particle conjugated prosthetic patches and methods of making and using thereof YALE UNIVERSITY (US) 2019-10-22 US disclosed
US-20180055972-A1 PARTICLE CONJUGATED PROSTHETIC PATCHES AND METHODS OF MAKING AND USING THEREOF YALE UNIVERSITY 2018-03-01 US disclosed
WO-2011014257-A9 APPROACHES TO TREAT CANCER USING HB-EGF INHIBITORS SUCH AS MYRSINOIC ACID A THE GENERAL HOSPITAL CORPORATION (US) 2012-03-01 WO disclosed
WO-2011014257-A1 APPROACHES TO TREAT CANCER USING HB-EGF INHIBITORS SUCH AS MYRSINOIC ACID A THE GENERAL HOSPITAL CORPORATION (US) 2011-02-03 WO disclosed
WO-2009132032-A2 SONIC HEDGEHOG MODULATORS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-10-29 WO disclosed
CN-1244803-A Soluble CTLA4 mutant molecules and uses thereof BRISTOL MYERS SQUIBB CO (US) 2000-02-16 CN disclosed