SCHEMBL28021939

SCHEMBL28021939

O=C(O)c1ccc(Oc2c(-c3ccccc3)ccc(-c3ccccc3)c2Oc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.58
PARP10 Q53GL7 2/20 0.50
PARP15 Q460N3 1/20 0.50
PKM P14618 1/20 0.49
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
NR4A1 P22736 1/20 0.46
NR4A2 P43354 1/20 0.46
NR4A3 Q92570 1/20 0.46
POLB P06746 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
DAO P14920 1/20 0.45
TSHR P16473 1/20 0.45
NAPRT Q6XQN6 1/20 0.45
LPAR1 Q92633 2/20 0.45
LPAR5 Q9H1C0 2/20 0.45

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
SCHEMBL21177729 0.91 SRD5A2 (0.56) SRD5A2PARP10PARP15PKMRXRA
SCHEMBL28021937 0.86 SRD5A2 (0.47) SRD5A2PARP10PARP15PKMRXRA
SCHEMBL23908714 0.85 RXRA (0.51) SRD5A2PARP10PARP15RXRARXRB
SCHEMBL28021940 0.81 AKR1C3 (0.67) NR4A2POLB
Biphenyl SCHEMBL20561236 0.81 SRD5A2 (0.71) SRD5A2PARP10PARP15PKMNR4A1
SCHEMBL11419154 0.81 SRD5A2 (0.71) SRD5A2PARP10PARP15PKMRXRA
SCHEMBL4326298 0.81 NCOA1 (0.62) SRD5A2PARP10PARP15RXRARXRB
SCHEMBL21178077 0.80 EGFR (0.64) SRD5A2RXRARXRBRXRG
SCHEMBL2710776 0.80 SRD5A2 (0.65) SRD5A2PARP10PARP15PKMRXRA
SCHEMBL9346099 0.80 RXRA (0.46) SRD5A2RXRARXRBRXRGLPAR1

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
CN-104854165-A Resin precursor, resin composition containing the same, resin film and method for producing the same, and laminate and method for producing the same ASAHI KASEI E MATERIALS CORP 2015-08-19 CN disclosed