SCHEMBL9154263

SCHEMBL9154263

CCCC(C)OC(=O)c1ccc(OC(C)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.49
ELANE P08246 4/20 0.46
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
TAS1R3 Q7RTX0 2/20 0.41
TAS1R1 Q7RTX1 2/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41
PGR P06401 1/20 0.41
CHRM2 P08172 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
CHRM1 P11229 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL10422540 0.96 HSD17B10 (0.53) TSHRELANEHSD17B10L3MBTL1LMNA
SCHEMBL8610838 0.91 TSHR (0.53) TSHRELANEHSD17B10L3MBTL1LMNA
SCHEMBL9156662 0.89 ALDH1A1 (0.53) TSHRELANEL3MBTL1LMNAKMT2A
SCHEMBL6865273 0.89 ALDH1A1 (0.53) TSHRELANEL3MBTL1LMNAKMT2A
SCHEMBL7799666 0.89 ALDH1A1 (0.53) TSHRELANEL3MBTL1LMNAKMT2A
SCHEMBL9629230 0.88 ELANE (0.49) TSHRELANEHSD17B10L3MBTL1LMNA
SCHEMBL828610 0.87 TSHR (0.51) TSHRL3MBTL1TAS1R3TAS1R1ESR1
SCHEMBL6871505 0.85 ALDH1A1 (0.50) TSHRHSD17B10L3MBTL1LMNAKMT2A
SCHEMBL9296056 0.85 ALDH1A1 (0.50) TSHRHSD17B10L3MBTL1LMNAKMT2A
SCHEMBL509045 0.84 TAS1R3 (0.55) TSHRELANEL3MBTL1KMT2ATAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0450595-B1 Liquid crystal compound and liquid crystal display device MITSUBISHI GAS CHEMICAL CO (JP) 1995-03-01 EP disclosed
US-5374375-A Antiferroelectric phase; used in the field of information, office automation appliances, and television; higher display qualities and higher resolution MITSUBISHI GAS CHEMICAL CO., INC. (JP) 1994-12-20 US disclosed
EP-0258898-B1 LIQUID-CRYSTALLINE POLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-04-22 EP disclosed
EP-0450595-A1 Liquid crystal compound and liquid crystal display device MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1991-10-09 EP disclosed
US-4818807-A Liquid-crystalline polymer IDEMITSU KOSAN CO., LTD. (JP) 1989-04-04 US disclosed
EP-0258898-A2 Liquid-crystalline polymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1988-03-09 EP disclosed