SCHEMBL28341981

SCHEMBL28341981

Cc1cccc(Nc2ccc(O)cc2)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.50
MT-CO2 P00403 1/20 0.50
TDP1 Q9NUW8 4/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 3/20 0.49
MEN1 O00255 2/20 0.49
CYP3A4 P08684 2/20 0.49
HIF1A Q16665 2/20 0.49
TRPA1 O75762 2/20 0.49
PTGS2 P35354 2/20 0.49
AKR1B10 O60218 1/20 0.49
ABCB11 O95342 1/20 0.49
DHFR P00374 1/20 0.49
MPO P05164 1/20 0.49
CYP1A2 P05177 1/20 0.49
CHRM1 P11229 1/20 0.49
CYP2C9 P11712 1/20 0.49
AKR1B1 P15121 1/20 0.49
PTGS1 P23219 1/20 0.49
AKR1C3 P42330 1/20 0.49

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
SCHEMBL1922752 0.90 RAPGEF4 (0.59) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL1922114 0.84 RAPGEF4 (0.53) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL7974336 0.84 RAPGEF4 (0.53) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL11019437 0.84 AURKA (0.56) TDP1KMT2ALMNAMEN1CYP3A4
SCHEMBL29550941 0.82 TDP1 (0.54) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL22772445 0.82 TDP1 (0.54) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL429858 0.82 MEN1 (0.58) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL30594032 0.82 MEN1 (0.58) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL11567799 0.81 RAPGEF4 (0.59) RAPGEF4TDP1KMT2ALMNAMEN1
SCHEMBL7974344 0.81 MAPT (0.55) RAPGEF4TDP1KMT2ALMNAMEN1

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-110627800-B Light reversible stimulus response fluorescent material and application thereof 吉林大学 2021-08-20 CN disclosed
CN-110627800-A Light reversible stimulus response fluorescent material and application thereof 吉林大学 2019-12-31 CN disclosed