SCHEMBL577074

SCHEMBL577074

Cc1cc(OCCO)c(C(C)(C)C)cc1C1c2ccccc2-c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.38
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 5/20 0.36
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
GAA P10253 2/20 0.33
ADRB2 P07550 2/20 0.33
LMNA P02545 2/20 0.33
ADRB1 P08588 1/20 0.33
HTR7 P34969 1/20 0.33
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HTT P42858 2/20 0.32

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
SCHEMBL577661 0.81 KDM4E (0.40) ARALDH1A1KDM4EALOX5APFEN1
SCHEMBL29632775 0.75 PDK2 (0.41) ARALDH1A1KDM4EGAAADRB2
SCHEMBL1073881 0.75 PDK2 (0.41) ARALDH1A1KDM4EGAAADRB2
SCHEMBL28896928 0.75 TP53 (0.50) ARALDH1A1KDM4EALOX5APFEN1
SCHEMBL577512 0.74 L3MBTL1 (0.39) ARALDH1A1KDM4EALOX5APFEN1
SCHEMBL11645998 0.72 LMNA (0.44) ALDH1A1KDM4ETP53MAPK1GAA
SCHEMBL577075 0.71 AR (0.35) ARALDH1A1KDM4ERAB9AGAA
SCHEMBL577259 0.70 SCN8A (0.36) ARALDH1A1KDM4EALOX5APFEN1
SCHEMBL8142983 0.68 ALDH1A1 (0.65) ALDH1A1KDM4ETP53MAPK1GAA
SCHEMBL2246552 0.68 L3MBTL1 (0.57) ALDH1A1KDM4ETP53MAPK1GAA

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
EP-2418253-A1 POLYCARBONATE RESIN COMPOSITION, PROCESS FOR PRODUCING MOLDED ARTICLE THEREFROM, AND OPTICAL LENS Mitsubishi Gas Chemical Company, Inc. (JP) 2012-02-15 EP disclosed