SCHEMBL11233697

SCHEMBL11233697

Cc1cc(CC=Cc2ccccc2)c(O)c(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
PTPN6 P29350 4/20 0.47
PTGER4 P35408 2/20 0.47
PTGER3 P43115 2/20 0.47
PTGER2 P43116 2/20 0.47
HNF4A P41235 1/20 0.44
PTPN2 P17706 3/20 0.43
PAM P19021 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
MAOA P21397 1/20 0.42

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
SCHEMBL24075586 0.84 ALOX5 (0.53) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL11337079 0.81 HMGB1 (0.55) PTPN1KDM4EALDH1A1MAPTMEN1
SCHEMBL11337082 0.81 HMGB1 (0.55) PTPN1KDM4EALDH1A1MAPTMEN1
SCHEMBL11229672 0.80 PTGER4 (0.47) PTPN1KDM4EALDH1A1MAPTMEN1
SCHEMBL11578063 0.79 HSPA5 (0.54) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL11788209 0.79 KDM4E (0.46) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL11578059 0.79 HSPA5 (0.54) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL148483 0.79 KDM4E (0.54) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL148484 0.79 KDM4E (0.54) KDM4EALDH1A1MAPTMEN1RECQL
SCHEMBL3965068 0.77 HSD17B10 (0.41) PTPN1KDM4EALDH1A1MEN1KMT2A

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-4317917-A ANTIINFLAMMATORY, ANALGESIC, ANTIBACTERIAL AUSONIA FARMACEUTICI S.R.L. (IT) 1982-03-02 US disclosed