SCHEMBL1965626

SCHEMBL1965626

[CH2]C1=Cc2ccccc21

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
SCHEMBL133154 0.72 MAPK1 (0.52)
SCHEMBL5886591 0.69 ABCG2 (0.39)
SCHEMBL10354666 0.69 ABCG2 (0.39)
SCHEMBL9118090 0.67 ABCG2 (0.38)
SCHEMBL7038230 0.67
SCHEMBL9118644 0.65 ALDH1A1 (0.32)
SCHEMBL329788 0.65 ALDH1A1 (0.36)
SCHEMBL17601832 0.65 GPR84 (0.33)
SCHEMBL10795752 0.65 CDC25A (0.32)
SCHEMBL7270394 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528734-A1 Thiazolidin-2,4-dione derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1993-02-24 EP claimed
US-10202400-B2 Cortistatin analogues and syntheses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-02-12 US disclosed
US-20170320886-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-11-09 US disclosed
US-9714255-B2 Cortistatin analogues and syntheses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2017-07-25 US disclosed
US-20150376201-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-12-31 US disclosed
US-9127019-B2 Cortistatin analogues and synthesis thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-09-08 US disclosed
US-20150111921-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEROF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-04-23 US disclosed
US-20110190323-A1 CORTISTATIN ANALOGUES AND SYNTHESES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-08-04 US disclosed
EP-2334686-A2 CORTISTATIN ANALOGUES AND SYNTHESES THEROF President and Fellows of Harvard College (US) 2011-06-22 EP disclosed
WO-2010024930-A2 CORTISTATIN ANALOGUES AND SYNTHESES THEROF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-03-04 WO disclosed
EP-0494817-B1 Benzisoxazole and benzisothiazole derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1995-09-06 EP disclosed
EP-0490772-B1 1,4-Disubstituted piperazines, their process of preparation and pharmaceutical compositions containing them ADIR (FR) 1995-07-26 EP disclosed
EP-0494817-A1 Benzisoxazole and benzisothiazole derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-07-15 EP disclosed
EP-0490772-A1 1,4-Disubstituted piperazines, their process of preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-06-17 EP disclosed