SCHEMBL3501512

SCHEMBL3501512

CCCCC(CC)CNC(=O)CC(C)=O.[CaH2]

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
ALDH1A1 P00352 5/20 0.50
CYP3A4 P08684 2/20 0.50
HTT P42858 4/20 0.47
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 2/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GLA P06280 1/20 0.47
CA2 P00918 2/20 0.43
KMT2A Q03164 2/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL362747 0.98 TSHR (0.52) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL16312317 0.89 TSHR (0.57) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL12180618 0.84 TSHR (0.52) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL8515067 0.84 TSHR (0.55) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL8600740 0.84 TSHR (0.55) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL10644460 0.83 TSHR (0.50) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL14836356 0.82 TSHR (0.53) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL1165645 0.82 TSHR (0.53) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL11663143 0.82 TSHR (0.53) TSHRALDH1A1CYP3A4HTTLMNA
SCHEMBL18638052 0.82 TSHR (0.57) TSHRALDH1A1CYP3A4HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160369237-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY ADVANCED CELL TECH INC (US) 2016-12-22 US disclosed
US-20100184033-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY Lineage Cell Therapeutics, Inc. 2010-07-22 US disclosed
EP-1903873-A2 HERPES VIRUS-BASED COMPOSITIONS AND METHODS OF USE IN THE PRENATAL AND PERINATAL PERIODS THE UNIVERSITY OF ROCHESTER (US) 2008-04-02 EP disclosed
US-20080070303-A1 Using myocardial and/or muscle progenitor cells as modeling tool in tissue engineering; regenerative medicine and organ replacement ADVANCED CELL TECHNOLOGY 2008-03-20 US disclosed
WO-2007062198-A1 METHODS TO ACCELERATE THE ISOLATION OF NOVEL CELL STRAINS FROM PLURIPOTENT STEM CELLS AND CELLS OBTAINED THEREBY ADVANCED CELL TECHNOLOGY, INC. (US) 2007-05-31 WO disclosed
WO-2006135602-A2 HERPES VIRUS-BASED COMPOSITIONS AND METHODS OF USE IN THE PRENATAL AND PERINATAL PERIODS UNIVERSITY OF ROCHESTER (US) 2006-12-21 WO disclosed