SCHEMBL9501757

SCHEMBL9501757

CC(C)(C)c1ccc(OC[C]=O)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
CYP2C19 P33261 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 6/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 3/20 0.38
GAA P10253 2/20 0.37
APEX1 P27695 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36

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
SCHEMBL5807071 0.83 USP2 (0.45) MAPK1PTGDR2MAPTKDM4ECA2
SCHEMBL7090155 0.82 CYP2C19 (0.61) MAPK1NPSR1CYP2C19MAPTKDM4E
SCHEMBL27170735 0.80 KDM4E (0.45) MAPK1NPSR1CYP2C19PTGDR2MAPT
SCHEMBL75920 0.80 MAPK1 (0.59) MAPK1NPSR1MAPTSMN1; SMN2ALDH1A1
SCHEMBL6671333 0.79 ALDH1A1 (0.47) MAPK1NPSR1CYP2C19PTGDR2MAPT
SCHEMBL10651246 0.77 KDM4E (0.42) MAPK1NPSR1CYP2C19PTGDR2MAPT
SCHEMBL6549878 0.77 CA1 (0.42) MAPK1NPSR1CYP2C19PTGDR2MAPT
SCHEMBL5807025 0.77 ALDH1A1 (0.53) MAPK1NPSR1CYP2C19MAPTKDM4E
SCHEMBL9502507 0.77 KDM4E (0.39) KDM4ESMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL958236 0.76 EGFR (0.48) MAPK1NPSR1CYP2C19PTGDR2MAPT

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
EP-0324917-B1 LOW PLATE-OUT POLYCARBONATES GENERAL ELECTRIC COMPANY (US) 1993-06-30 EP claimed
EP-0324917-A1 Low plate-out polycarbonates GENERAL ELECTRIC COMPANY (US) 1989-07-26 EP claimed
US-4841015-A Low plate-out polycarbonate end capped with phenoxy acetic acid GENERAL ELECTRIC COMPANY (US) 1989-06-20 US claimed