SCHEMBL23135208

SCHEMBL23135208

C/C(N)=C\C=C(/C)N(C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 1/20 0.46
▸ PHGDH O43175 1/20 0.46
▸ MGLL Q99685 1/20 0.46
▸ LMNA P02545 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ SIGMAR1 Q99720 1/20 0.38
▸ KMT2A Q03164 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL12557522 0.79 FAAH (0.44) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL23991849 0.78 FAAH (0.47) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL14535097 0.78 FAAH (0.47) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL25645809 0.78 FAAH (0.43) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL19012309 0.77 LMNA (0.52) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL14535098 0.77 LMNA (0.52) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL24621420 0.77 FAAH (0.46) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL23308929 0.74 FAAH (0.43) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL12411238 0.74 LMNA (0.48) FAAHPHGDHMGLLLMNAL3MBTL1
SCHEMBL20888657 0.69 ALDH1A1 (0.34) ALDH1A1

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
US-20210087493-A1 Method Of Lubricating An Internal Combustion Engine THE LUBRIZOL CORPORATION (US) 2021-03-25 — — US disclosed
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