SCHEMBL11773551

SCHEMBL11773551

O=C(O)c1cc(C2CCCCC2)c(O)c(O)c1O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
KMT2A Q03164 1/20 0.51
ACMSD Q8TDX5 2/20 0.50
KMO O15229 2/20 0.40
CAMKK2 Q96RR4 4/20 0.40
HSP90AA1 P07900 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
CAMKK1 Q8N5S9 2/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
PTGDR2 Q9Y5Y4 6/20 0.36
PTGDR Q13258 3/20 0.36
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
PTGER2 P43116 1/20 0.36
DHODH Q02127 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
SCHEMBL11776420 0.86 KDM4E (0.51) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL2533444 0.84 ACMSD (0.61) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL9244562 0.83 KDM4E (0.49) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL7423654 0.83 KDM4E (0.49) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL7955284 0.83 ACMSD (0.59) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL9249778 0.83 AKR1C4 (0.53) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL10696750 0.80 KDM4E (0.47) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL11775054 0.79 KDM4E (0.46) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL11775718 0.79 KDM4E (0.46) KDM4EMEN1MAPTKMT2AACMSD
SCHEMBL9250275 0.79 PTPN1 (0.55) KDM4EMEN1MAPTKMT2AACMSD

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-3983292-A Pressure sensitive recording papers SANKO CHEMICAL COMPANY LTD. (JA) 1976-09-28 US disclosed