SCHEMBL23552995

SCHEMBL23552995

C=CC(=O)OCCOc1ccc(-c2ccc(-c3ccc(CCC)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.64
ALDH1A1 P00352 1/20 0.51
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
RARB P10826 4/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KMT2A Q03164 2/20 0.43
NPC1 O15118 1/20 0.43
MEN1 O00255 1/20 0.43
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42

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
SCHEMBL21127912 1.00 THRB (0.64) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL2153760 0.96 THRB (0.69) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL8672438 0.92 THRB (0.64) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL3901525 0.90 THRB (0.66) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL14597299 0.90 THRB (0.66) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL14117091 0.89 THRB (0.64) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL14010389 0.89 THRB (0.64) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL9418508 0.88 THRB (0.75) THRBALDH1A1HPGDTSHRL3MBTL1
SCHEMBL11032806 0.87 THRB (0.65) THRBALDH1A1HPGDTSHRLMNA
SCHEMBL28574008 0.86 THRB (0.61) THRBALDH1A1HPGDTSHRLMNA

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-20210189239-A1 LIQUID CRYSTAL COMPOSITION, RETARDATION FILM, METHOD FOR PRODUCING RETARDATION FILM, TRANSFER LAMINATE, OPTICAL MEMBER, METHOD FOR PRODUCING OPTICAL MEMBER, AND DISPLAY DEVICE DAI NIPPON PRINTING CO., LTD. (JP) 2021-06-24 US disclosed