SCHEMBL28920293

SCHEMBL28920293

COc1ccc(N)c(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.68
MAPT P10636 5/20 0.68
NPSR1 Q6W5P4 1/20 0.68
RAB9A P51151 1/20 0.57
ALDH1A1 P00352 3/20 0.50
CYP3A4 P08684 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 2/20 0.44
ATM Q13315 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 2/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ICAM1 P05362 1/20 0.42
SELE P16581 1/20 0.42
PPP1CA P62136 1/20 0.42
KMT2A Q03164 1/20 0.42
CACNA1D Q01668 1/20 0.42
PPARG P37231 2/20 0.42
P2RY1 P47900 1/20 0.42

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
SCHEMBL30010505 1.00 L3MBTL1 (0.68) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL22559285 0.85 L3MBTL1 (0.68) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL13791556 0.81 L3MBTL1 (0.65) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL24751467 0.81 L3MBTL1 (0.66) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL22809770 0.81 MAPT (0.62) L3MBTL1MAPTNPSR1RAB9ALMNA
SCHEMBL31694813 0.81 L3MBTL1 (0.66) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL167016 0.81 L3MBTL1 (0.58) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL29782607 0.81 L3MBTL1 (0.58) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL1341034 0.80 L3MBTL1 (0.60) L3MBTL1MAPTNPSR1RAB9AALDH1A1
SCHEMBL15832050 0.80 L3MBTL1 (0.60) L3MBTL1MAPTNPSR1RAB9ACYP3A4

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-115356315-A Method for detecting hydrogen sulfide by fluorane derivative probe 沈阳感光化工研究院有限公司 2022-11-18 CN disclosed