SCHEMBL26214211

SCHEMBL26214211

C=C(/C=C\C)c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ TNFRSF1A P19438 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ PTBP1 P26599 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ NFE2L2 Q16236 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
SCHEMBL12087611 0.80 MAPT (0.50) MAPTCYP1A2CYP2C19LMNASMN1; SMN2
SCHEMBL24603480 0.78 CYP1A2 (0.62) MAPTCYP1A2CYP2C19MAOAMAOB
SCHEMBL8377034 0.78 CYP1A1 (0.45) CYP1A2CES2CES1MAOB
SCHEMBL24884748 0.78 MAOB (0.39) MAPTCYP1A2CYP2C19CES2CES1
SCHEMBL1071816 0.77 AKT1 (0.38) MAPTCES2CES1LMNASMN1; SMN2
SCHEMBL18380950 0.77 AKT1 (0.38) MAPTCES2CES1LMNASMN1; SMN2
SCHEMBL1071814 0.77 AKT1 (0.38) MAPTCES2CES1LMNASMN1; SMN2
SCHEMBL24914456 0.76 CES2 (0.47) CES2CES1LMNANFE2L2
SCHEMBL19265018 0.76 MAPT (0.41) MAPTCYP1A2CYP2C19CES2CES1
SCHEMBL14472693 0.75 MAOA (0.48) MAPTCYP1A2CYP2C19CES2CES1

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
WO-2023237651-A1 METHOD FOR THE PREPARATION OF A 3,6-DIHYDRO-2H-1,3,4-OXADIAZIN-2-ONE BAYER AKTIENGESELLSCHAFT (DE) 2023-12-14 — — WO disclosed
US-20230276692-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-31 — — US disclosed
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