SCHEMBL9259441

SCHEMBL9259441

CC[C@H](C)COCCCCc1ccc(OC(C)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
KMT2A Q03164 1/20 0.43
THRA P10827 1/20 0.43
LMNA P02545 1/20 0.39
FFAR1 O14842 1/20 0.39
GLS O94925 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL9254260 0.96 KMT2A (0.44) THRBL3MBTL1KMT2ATHRALMNA
SCHEMBL9261995 0.85 THRB (0.44) THRBL3MBTL1KMT2ATHRALMNA
SCHEMBL9259443 0.83 THRB (0.60) THRBL3MBTL1KMT2ATHRALMNA
SCHEMBL9259374 0.82 MAPT (0.55) KMT2A
SCHEMBL9262000 0.82 THRB (0.51) THRBL3MBTL1KMT2ATHRALMNA
SCHEMBL9256267 0.81 ESR1 (0.50) L3MBTL1LMNATDP1PTGS2
SCHEMBL9256263 0.81 ESR1 (0.50) L3MBTL1LMNATDP1PTGS2
SCHEMBL9254264 0.80 THRB (0.56) THRBL3MBTL1KMT2ATHRALMNA
SCHEMBL9257559 0.80 SMN1; SMN2 (0.56) THRBKMT2ATHRALMNANPC1
SCHEMBL10744204 0.80 HSD17B10 (0.45) THRBKMT2ATHRALMNANPC1

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-5385693-A Having rapid response and low phase transition temperature SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0357372-B1 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL CO (JP) 1994-11-17 EP disclosed
US-5264151-A Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5124070-A High speed response SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-23 US disclosed
EP-0357372-A2 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed