SCHEMBL29266106

SCHEMBL29266106

CCCCc1cc(O)cc(CCCC)c1C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGES O14684 3/20 0.51
TOP2A P11388 1/20 0.51
ALOX5 P09917 4/20 0.49
PTGS2 P35354 3/20 0.47
PTPN1 P18031 5/20 0.47
PTPN11 Q06124 3/20 0.47
CYP3A4 P08684 1/20 0.46
ACHE P22303 1/20 0.46
PTPN2 P17706 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
TYR P14679 1/20 0.43
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 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
SCHEMBL24206472 0.92 PTGES (0.61) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL7333042 0.89 PTPN1 (0.59) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL2762730 0.87 PTGES (0.67) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL29683894 0.87 PTGES (0.67) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL29266100 0.85 NR1H2 (0.59) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL29266101 0.82 ALOX5 (0.56) PTGESTOP2AALOX5PTPN1PTPN11
SCHEMBL18051745 0.81 PTPN1 (0.68) PTGESTOP2APTPN1PTPN11CYP3A4
SCHEMBL2535209 0.80 CNR2 (0.41) PTGESTOP2AALOX5CNR1CNR2
SCHEMBL11316808 0.78 CNR2 (0.54) PTGESTOP2AALOX5PTGS2PTPN1
SCHEMBL13212709 0.76 KDM4E (0.52) ALOX5PTGS2CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113748021-B Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2024-07-05 CN claimed
CN-113748021-B Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2024-07-05 CN disclosed