SCHEMBL8719485

SCHEMBL8719485

CC(O)Cc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 4/20 0.58
ADRB3 P13945 4/20 0.58
RARB P10826 6/20 0.54
ALDH1A1 P00352 2/20 0.52
RXRA P19793 2/20 0.51
RXRB P28702 2/20 0.51
SRD5A2 P31213 1/20 0.51
MEN1 O00255 1/20 0.51
RARA P10276 1/20 0.51
MAPT P10636 1/20 0.51
MTOR P42345 1/20 0.51
KMT2A Q03164 1/20 0.51
ANPEP P15144 1/20 0.50
ENPEP Q07075 1/20 0.50
ACACB O00763 1/20 0.48
RXRG P48443 1/20 0.47
BCL2 P10415 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
SCHEMBL4598268 0.94 ALDH1A1 (0.57) ADRB1ADRB3RARBALDH1A1RXRA
SCHEMBL9369118 0.87 ADRB3 (0.56) ADRB1ADRB3RARBALDH1A1RXRA
SCHEMBL8158955 0.85 MMP12 (0.54) ADRB1ADRB3ALDH1A1MEN1MAPT
SCHEMBL1336531 0.84 ALDH1A1 (0.46) ADRB1ADRB3ALDH1A1
SCHEMBL9335694 0.82 RARB (0.56) ADRB1ADRB3RARBALDH1A1RXRA
SCHEMBL3084046 0.82 RARB (0.56) ADRB1ADRB3RARBALDH1A1RXRA
SCHEMBL10900937 0.80 USP2 (0.53) ADRB1ADRB3ALDH1A1KMT2AANPEP
SCHEMBL8721457 0.80 ALDH1A1 (0.58) ALDH1A1MAPTACACB
SCHEMBL452233 0.80 PTGS1 (0.60) ADRB3RARBALDH1A1KMT2AANPEP
SCHEMBL3182075 0.80 BDKRB2 (0.47) ADRB3RARBALDH1A1SRD5A2MAPT

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-5741438-A Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as an effective component, and liquid crystal element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-04-21 US disclosed
EP-0395390-B1 Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL CO (JP) 1994-09-28 EP disclosed
EP-0395390-A1 Optically active biphenyl derivative, process for preparation thereof, liquid crystal composition containing the same as effective component, and liquid crystal element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-10-31 EP disclosed