SCHEMBL28116437

SCHEMBL28116437

Cc1ccc(C(=O)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.66
TDP1 Q9NUW8 2/20 0.55
MAPK13 O15264 1/20 0.55
MAPK12 P53778 1/20 0.55
MAPK11 Q15759 1/20 0.55
MAPK14 Q16539 1/20 0.55
CDC25B P30305 1/20 0.53
ATM Q13315 1/20 0.53
ALDH1A1 P00352 6/20 0.52
LMNA P02545 3/20 0.52
BCAT2 O15382 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPT P10636 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
SRD5A2 P31213 1/20 0.50

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
SCHEMBL30448294 0.97 AKR1C3 (0.67) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL29843143 0.95 AKR1C3 (0.62) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL21183186 0.95 AKR1C3 (0.62) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL5693606 0.93 AKR1C3 (0.61) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL6911946 0.88 AKR1C3 (0.60) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL30791463 0.87 CDC25B (0.69) AKR1C3MAPK13MAPK12MAPK11MAPK14
SCHEMBL23758169 0.87 SLC6A4 (0.56) AKR1C3TDP1ALDH1A1LMNAMEN1
SCHEMBL8523127 0.87 HNF4A (0.60) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL15660913 0.87 SLC6A4 (0.56) AKR1C3TDP1MAPK13MAPK12MAPK11
SCHEMBL472751 0.87 ALDH1A1 (0.63) AKR1C3MAPK13MAPK12MAPK11MAPK14

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-114853632-A Efficient distillation and purification technology of sartanbiphenyl 江西大地制药有限责任公司 2022-08-05 CN disclosed
CN-106547168-A A kind of black-matrix material compositionss and application 深圳市华星光电技术有限公司 2017-03-29 CN disclosed