SCHEMBL14153993

SCHEMBL14153993

CCC(C)C(=O)NCCNC(=O)C(C)CC

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.61
USP2 O75604 2/20 0.61
GAA P10253 1/20 0.49
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CYP3A4 P08684 1/20 0.40
HSD17B10 Q99714 1/20 0.39
MMP8 P22894 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CNR1 P21554 1/20 0.38
MAPT P10636 1/20 0.37
GLS O94925 1/20 0.37

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
SCHEMBL12529983 0.91 TSHR (0.52) TSHRUSP2GAAMEN1KMT2A
SCHEMBL5021623 0.90 TSHR (0.50) TSHRUSP2GAAMEN1KMT2A
SCHEMBL17853878 0.90 USP2 (0.50) TSHRUSP2GAAMEN1KMT2A
SCHEMBL603918 0.88 TSHR (0.48) TSHRUSP2GAAMEN1KMT2A
SCHEMBL11913576 0.88 GAA (0.49) TSHRUSP2GAAMEN1KMT2A
SCHEMBL17527573 0.88 ALDH1A2 (0.52) TSHRUSP2GAAMEN1KMT2A
SCHEMBL603919 0.88 USP2 (0.54) TSHRUSP2GAAMEN1KMT2A
SCHEMBL14238600 0.88 USP2 (0.54) TSHRUSP2GAAMEN1KMT2A
SCHEMBL18685491 0.88 USP2 (0.54) TSHRUSP2GAAMEN1KMT2A
SCHEMBL24804157 0.86 DPP7 (0.48) TSHRUSP2GAAMMP8CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160177006-A1 ION EXCHANGE FILM, COMPOSITION FOR FORMING ION EXCHANGE FILM, AND PRODUCTION METHOD FOR ION EXCHANGE FILM FUJIFILM CORPORATION (JP) 2016-06-23 US disclosed
US-7186786-B2 Chain transfer agents for RAFT polymerization in aqueous media UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2007-03-06 US disclosed