SCHEMBL9155164

SCHEMBL9155164

CCCCCC(C)OC(=O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53
CA14 Q9ULX7 2/20 0.53
ALDH1A1 P00352 3/20 0.52
ESR1 P03372 4/20 0.51
TSHR P16473 3/20 0.51
LMNA P02545 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
MAPK1 P28482 1/20 0.51
CYP2C19 P33261 1/20 0.51
NR1H2 P55055 1/20 0.51
RNASEL Q05823 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PNLIP P16233 1/20 0.48
HSD17B3 P37058 7/20 0.46
CHRM1 P11229 1/20 0.46

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
SCHEMBL9155155 1.00 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL6389315 1.00 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL7919363 0.99 ALDH1A1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL8751863 0.99 ALDH1A1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL6872338 0.99 ALDH1A1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL6937325 0.99 ALDH1A1 (0.54) CA12CA1CA2CA7CA9
SCHEMBL9150786 0.96 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL9150793 0.96 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL6390359 0.96 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL4651346 0.96 CA12 (0.57) CA12CA1CA2CA7CA9

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-5437816-A Compatible with low molecular weight liquid crystals to form uniform mixtures IDEMITSU KOSAN CO., LTD. (JP) 1995-08-01 US disclosed
US-5336435-A High polymer and ferroelectric liquid crystal composition utilizing same IDEMITSU KOSAN CO., LTD. (JP) 1994-08-09 US disclosed
US-5264517-A A-C copoly IDEMITSU KOSAN CO., LTD. (JP) 1993-11-23 US disclosed
EP-0548808-A2 High polymer and ferroelectric liquid crystal composition utilizing same IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-06-30 EP disclosed
EP-0542305-A2 High polymer and ferroelectric liquid crystal composition utilizing same IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-05-19 EP disclosed