SCHEMBL7074081

SCHEMBL7074081

C=C(CCC(C)Oc1c(Br)cc(Br)cc1Br)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.40
THRB P10828 9/20 0.38
THRA P10827 8/20 0.38
L3MBTL1 Q9Y468 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
MCL1 Q07820 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL7077532 0.83 HSD17B10 (0.35) HSD17B10THRBTHRAMEN1KMT2A
SCHEMBL7079450 0.80 HSD17B10 (0.35) HSD17B10THRBTHRA
SCHEMBL5586405 0.75 THRB (0.42) HSD17B10THRBTHRAMEN1KMT2A
SCHEMBL7067884 0.75 THRB (0.40) HSD17B10THRBTHRAMEN1KMT2A
SCHEMBL7067550 0.74 THRA (0.40) HSD17B10THRBTHRAMEN1KMT2A
SCHEMBL449703 0.74 THRA (0.44) HSD17B10THRBTHRAMEN1KMT2A
SCHEMBL446021 0.74 MTNR1A (0.50) MEN1KMT2AALDH1A1CYP1A2
SCHEMBL28454460 0.73 THRA (0.40) THRBTHRACYP1A2HTT
SCHEMBL16334625 0.73 THRA (0.40) THRBTHRACYP1A2HTT
SCHEMBL16334110 0.73 THRA (0.40) THRBTHRACYP1A2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030096172-A1 Hologram recording material composition and hologram recording medium DAISO CO., LTD. (JP) 2003-05-22 US disclosed