SCHEMBL7538700

SCHEMBL7538700

CC(C)OC(=O)C=CC(=O)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.47
NAAA Q02083 1/20 0.38
CYP19A1 P11511 5/20 0.38
CYP17A1 P05093 4/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 2/20 0.36
THRB P10828 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
EPHX2 P34913 2/20 0.35
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
AKR1B10 O60218 1/20 0.35
CA1 P00915 1/20 0.35
AKR1B1 P15121 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
EPHX1 P07099 1/20 0.33

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
SCHEMBL7538695 1.00 HCAR2 (0.47) HCAR2NAAACYP19A1CYP17A1NPSR1
SCHEMBL9274200 0.86 THRB (0.44) NAAACYP19A1CYP17A1NPSR1ALDH1A1
SCHEMBL7536676 0.86 THRB (0.44) NAAACYP19A1CYP17A1NPSR1ALDH1A1
SCHEMBL2307504 0.86 THRB (0.44) NAAACYP19A1CYP17A1NPSR1ALDH1A1
SCHEMBL7543054 0.79 HCAR2 (0.40) HCAR2ALDH1A1THRBLMNAHTT
SCHEMBL7543056 0.79 HCAR2 (0.40) HCAR2ALDH1A1THRBLMNAHTT
SCHEMBL7543047 0.79 HCAR2 (0.40) HCAR2ALDH1A1THRBLMNAHTT
SCHEMBL16731842 0.79 NPSR1 (0.42) NAAACYP19A1CYP17A1NPSR1ALDH1A1
SCHEMBL9274202 0.79 THRB (0.55) HCAR2NAAACYP19A1CYP17A1NPSR1
SCHEMBL1337905 0.79 NPSR1 (0.42) NAAACYP19A1CYP17A1NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020190818-A1 High frequency band pass filter TDK CORPORATION (JP) 2002-12-19 US disclosed
EP-0788118-B1 Low dielectric polymer and film, substrate and electronic part using the same TDK CORP (JP) 2002-11-20 EP disclosed
US-5914283-A FUMARIC ACID DIESTER MONOMER-CONTAINING POLYMER FILM; HEAT RESISTANCE, WEATHER RESISTANCE TDK CORPORATION (JP) 1999-06-22 US disclosed
EP-0788118-A1 Low dielectric polymer and film, substrate and electronic part using the same TDK Corporation (JP) 1997-08-06 EP disclosed