SCHEMBL5036112

SCHEMBL5036112

O=C(O)C(CC1Cc2ccccc2N1)=C(F)F

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
MTNR1A P48039 4/20 0.39
CREBBP Q92793 2/20 0.36
MC4R P32245 3/20 0.35
MTNR1B P49286 1/20 0.35
PNMT P11086 1/20 0.33
BRD4 O60885 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGB2 P05107 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGAV P06756 1/20 0.33
ITGA2B P08514 1/20 0.33
ITGA5 P08648 1/20 0.33
ITGB5 P18084 1/20 0.33
ITGAL P20701 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL5152873 0.82 GAA (0.57) GAAMAPTMTNR1ACREBBPMC4R
Hydrochloric Acid SCHEMBL9544373 0.80 GAA (0.56) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL27719438 0.79 MAPT (0.48) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL18707926 0.77 GAA (0.51) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL7654395 0.77 GAA (0.51) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL3123562 0.77 GAA (0.51) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL7416734 0.77 GAA (0.51) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL8905113 0.74 EGFR (0.49) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL5547311 0.73 GAA (0.46) GAAMAPTMTNR1ACREBBPMC4R
SCHEMBL13362022 0.73 GAA (0.46) GAAMAPTMTNR1ACREBBPMTNR1B

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-20080275153-A1 UV curable resin, its preparation and composition containing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2008-11-06 US disclosed