SCHEMBL415014

SCHEMBL415014

Cc1cccc(-c2nocc2-c2ccc3nccnc3c2)n1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TGFBR1 P36897 20/20 0.67
▸ MAPK14 Q16539 2/20 0.56
▸ MTOR P42345 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL5875577 0.84 TGFBR1 (0.48) TGFBR1MAPK14
SCHEMBL18005423 0.81 TGFBR1 (1.00) TGFBR1MAPK14MTOR
SCHEMBL5138951 0.78 TGFBR1 (0.67) TGFBR1MAPK14MTOR
SCHEMBL4030130 0.77 TGFBR1 (0.63) TGFBR1MAPK14MTOR
SCHEMBL4032785 0.76 TGFBR1 (0.62) TGFBR1MAPK14MTOR
SCHEMBL4031270 0.76 TGFBR1 (0.62) TGFBR1MAPK14MTOR
SCHEMBL15638339 0.75 TGFBR1 (0.81) TGFBR1MAPK14MTOR
SCHEMBL5875521 0.75 TGFBR1 (0.60) TGFBR1MAPK14
SCHEMBL5875566 0.74 TGFBR1 (0.45) TGFBR1MAPK14
SCHEMBL4032537 0.73 TGFBR1 (0.58) TGFBR1MAPK14MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030125-B2 Isothiazole and isoxazole compounds as transforming growth factor (TGF) inhibitors PFIZER, INC. (US) 2006-04-18 — — US claimed
US-20140120621-A1 TGF-BETA RECEPTOR INHIBITORS TO ENHANCE DIRECT REPROGRAMMING THE GENERAL HOSPITAL CORPORATION (US) 2014-05-01 — — US disclosed
US-8603818-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2013-12-10 — — US disclosed
US-8298825-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2012-10-30 — — US disclosed
US-20120021519-A1 EFFICIENT INDUCTION OF PLURIPOTENT STEM CELLS USING SMALL MOLECULE COMPOUNDS PRESIDENTS AND FELLOWS OF HARVARD COLLEGE (US) 2012-01-26 — — US disclosed
WO-2010033906-A2 EFFICIENT INDUCTION OF PLURIPOTENT STEM CELLS USING SMALL MOLECULE COMPOUNDS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-03-25 — — WO disclosed
US-7030125-B2 Isothiazole and isoxazole compounds as transforming growth factor (TGF) inhibitors PFIZER, INC. (US) 2006-04-18 — — US disclosed
US-20040116473-A1 Novel isothiazole and isoxazole compounds as transforming growth factor (TGF) inhibitors PFIZER INC 2004-06-17 — — US disclosed
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