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SCHEMBL3697799

SCHEMBL3697799

O=C1c2ccccc2C(=O)N1CCCn1cccc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ GLS O94925 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53

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
SCHEMBL4351612 0.88 TDP1 (0.66) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL6790333 0.83 TDP1 (0.71) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2
SCHEMBL8862878 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL2604742 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8863094 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL6777483 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8862728 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8863154 0.81 TDP1 (0.75) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL10856878 0.80 ESR1 (0.64) —
SCHEMBL6699936 0.79 GLS (0.71) TDP1L3MBTL1MAPTRAB9ASMN1; SMN2

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-20100016172-A1 Nucleic acid binding assay materials and methods ANSARI ASEEM Z 2010-01-21 — — US disclosed