SCHEMBL5845561

SCHEMBL5845561

CCOC(=O)c1ccc(-c2ccc(-c3ccccc3)cc2-c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARG P13631 15/20 0.52
RARB P10826 12/20 0.52
RARA P10276 10/20 0.52
RXRA P19793 3/20 0.49
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
PDK2 Q15119 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
SCHEMBL5846968 0.87 RARG (0.55) RARGRARBRARARXRAPDK2
SCHEMBL5846075 0.84 RARB (0.60) RARGRARBRARARXRARAB9A
SCHEMBL5846597 0.84 RARG (0.62) RARGRARBRARARXRA
SCHEMBL5699634 0.83 RARG (0.52) RARGRARBRARARXRACA12
SCHEMBL6730351 0.82 RARB (0.53) RARGRARBRARARXRAPDK2
SCHEMBL5845556 0.82 RARG (0.57) RARGRARBRARARXRAMEN1
SCHEMBL7566777 0.81 RARB (0.57) RARGRARBRARARXRAMEN1
SCHEMBL5845951 0.81 RARG (0.56) RARGRARBRARARXRACA12
SCHEMBL3303798 0.80 CA12 (0.64) CA12CA1CA2CA7CA9
SCHEMBL5847708 0.80 PDK2 (0.49) RARGRARBRARARXRARAB9A

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-7148245-B2 Biphenyl derivatives substituted with an aromatic or heteroaromatic radical, and pharmaceutical and cosmetic compositions containing them GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-12-12 US disclosed