SCHEMBL25877477

SCHEMBL25877477

Cc1ccc(C(O)CN)cc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 5/20 0.69
TDP1 Q9NUW8 4/20 0.69
KDM4E B2RXH2 4/20 0.69
MAPT P10636 3/20 0.69
RECQL P46063 3/20 0.69
APEX1 P27695 3/20 0.69
TAAR1 Q96RJ0 3/20 0.69
ADRB3 P13945 3/20 0.69
HPGD P15428 2/20 0.69
LMNA P02545 2/20 0.69
MAPK1 P28482 2/20 0.69
ADRB2 P07550 2/20 0.69
ADRB1 P08588 2/20 0.69
ADRA2A P08913 2/20 0.69
ADRA2B P18089 2/20 0.69
ADRA2C P18825 2/20 0.69
ADRA1D P25100 2/20 0.69
MEN1 O00255 1/20 0.69
ADORA3 P0DMS8 1/20 0.69
DRD2 P14416 1/20 0.69

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
SCHEMBL7146918 0.85 BLM (0.69) BLMTDP1KDM4EMAPTRECQL
SCHEMBL19472347 0.85 BLM (0.69) BLMTDP1KDM4EMAPTRECQL
SCHEMBL12916560 0.82 TRPA1 (0.59) BLMTDP1KDM4EMAPTRECQL
Norepinephrine SCHEMBL29399946 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
L-Norepinephrine SCHEMBL29460319 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
L-Norepinephrine SCHEMBL2610 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
Norepinephrine SCHEMBL2429869 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
L-Norepinephrine SCHEMBL3489077 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
L-Norepinephrine SCHEMBL29371849 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL
Norepinephrine SCHEMBL2609 0.82 TDP1 (1.00) BLMTDP1KDM4EMAPTRECQL

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
EP-3521372-B1 QUINONE CURABLE COMPOSITIONS AND ADHESIVE COMPOSITIONS COMPRISING SAME KOLON INC (KR) 2023-08-02 EP disclosed