SCHEMBL29026422

SCHEMBL29026422

NN(Cc1ccc(C(F)(F)F)cc1)/N=C\C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LSS P48449 1/20 0.41
PDPK1 O15530 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SRD5A2 P31213 1/20 0.40
FFAR1 O14842 1/20 0.39
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39
NR4A3 Q92570 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
GRIN1 Q05586 1/20 0.37

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
SCHEMBL15110621 0.76 LSS (0.48) MTORMEN1KMT2ALSSSRD5A2
SCHEMBL6232804 0.73 TAAR1 (0.46) MTORMEN1KMT2ALSSSRD5A2
SCHEMBL2475473 0.69 LSS (0.48) MTORMEN1KMT2ALSSSRD5A2
SCHEMBL5069046 0.69 MEN1 (0.47) MTORMEN1KMT2ALSSSRD5A2
SCHEMBL3577181 0.69 MEN1 (0.55) MTORMEN1KMT2ALSSPDPK1
SCHEMBL4667136 0.68 MEN1 (0.45) MTORMEN1KMT2ALSSPDPK1
SCHEMBL8497602 0.67 ALDH1A1 (0.48) MTORMEN1KMT2ATAAR1GRIN2B
SCHEMBL7390057 0.67 MTOR (0.55) MTORMEN1KMT2ALSSPYCR1
Bicarbonate SCHEMBL25351097 0.67 MAOB (0.56) KMT2ASRD5A2TAAR1PSEN1PSEN2
SCHEMBL28888850 0.67 TAAR1 (0.50) KMT2ALSSSLC6A2SLC6A4TAAR1

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-116157394-A Compounds and compositions for the treatment of diseases associated with STING activity 艾福姆德尤股份有限公司 2023-05-23 CN disclosed