SCHEMBL3084656

SCHEMBL3084656

CC=CCCC=CCCC(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
AKT1 P31749 1/20 0.47
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
EPHX2 P34913 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CA12 O43570 1/20 0.39
CA14 Q9ULX7 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 2/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
ALOX5 P09917 1/20 0.37
OXER1 Q8TDS5 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
PPARG P37231 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
SCHEMBL21594794 1.00 TSHR (0.52) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL31275102 1.00 TSHR (0.52) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL23706440 1.00 TSHR (0.52) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL1759110 0.95
SCHEMBL1759112 0.95
SCHEMBL9188658 0.91 TSHR (0.63) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL2401513 0.91 TSHR (0.63) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL2401509 0.91 TSHR (0.63) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL16371432 0.84 TSHR (0.50) TSHRAKT1LMNAALDH1A1EPHX2
SCHEMBL23434850 0.84 TSHR (0.44) TSHRAKT1LMNAALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190391092-A1 METABOLIC PROFILING WITH MAGNETIC RESONANCE MASS SPECTROMETRY (MRMS) Oregon Institute of Science and Medicine 2019-12-26 US disclosed
US-PP21289-P3 Hop plant named ‘HBC 394’ Hop Breeding Company, L.L.C. (US) 2010-09-14 US disclosed
US-20090193555-P1 Hop plant named 'HBC 394' HOP BREEDING COMPANY, LLC 2009-07-30 US disclosed
US-PP15663-P2 Hop plant named ‘YCR Accession No. 4’ SELECT BOTANICALS GROUP, L.L.C. (US) 2005-03-15 US disclosed
US-PP12213-P2 Hop plant named ‘YCR Accession No. 14’ YAKIMA CHIEF RANCHES, INC. 2001-11-20 US disclosed