SCHEMBL11047142

SCHEMBL11047142

[CH2]C(=O)c1ccc(CCC)cc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.63
PLK1 P53350 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.56
POLB P06746 2/20 0.53
CTDSP1 Q9GZU7 2/20 0.53
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
THRA P10827 6/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
ESR1 P03372 1/20 0.50
ESR2 Q92731 1/20 0.50
MEN1 O00255 1/20 0.47
RARB P10826 1/20 0.47
LPL P06858 1/20 0.47
LIPG Q9Y5X9 1/20 0.47

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
SCHEMBL2088848 0.88 THRA (0.66) THRBPLK1POLBALDH1A1THRA
SCHEMBL11398616 0.84 THRA (0.73) THRBALDH1A1THRAKMT2AMAPT
SCHEMBL2464783 0.83 PLK1 (0.60) THRBPLK1L3MBTL1POLBCTDSP1
SCHEMBL9861628 0.82 PLK1 (0.64) THRBPLK1L3MBTL1POLBCTDSP1
SCHEMBL4211721 0.82 ALDH1A1 (0.64) THRBPLK1POLBALDH1A1GAA
SCHEMBL11645482 0.82 THRB (0.75) THRBPLK1L3MBTL1POLBCTDSP1
Hydrochloric Acid SCHEMBL27539972 0.81 PLK1 (0.58) THRBPLK1L3MBTL1POLBCTDSP1
SCHEMBL44017 0.80 RARB (0.69) THRBPLK1L3MBTL1POLBCTDSP1
SCHEMBL1483217 0.80 KMT2A (0.64) THRBPLK1L3MBTL1POLBCTDSP1
SCHEMBL4396484 0.80 PLK1 (0.62) THRBPLK1L3MBTL1POLBCTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4438277-A Hydronaphthalene derivatives SANKYO COMPANY, LIMITED (JP) 1984-03-20 US disclosed
US-4361515-A Antihyperlipemic dihydro-ML-236B derivatives, their preparation and use SANKYO COMPANY, LIMITED (JP) 1982-11-30 US disclosed
US-3971825-A (5,6) (10,11) BIS-METHYLENE, BRONCHODILATORS SANKYO COMPANY LIMITED (JA) 1976-07-27 US disclosed