SCHEMBL8828523

SCHEMBL8828523

CCCNc1c(C(=O)N(C)C)cncc1N1CCN(c2ccccc2O)CC1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ DRD2 P14416 1/20 0.39

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
Hydrochloric Acid SCHEMBL8828645 0.90 DRD2 (0.39) DRD2
Hydrochloric Acid SCHEMBL8828477 0.88 KDM4E (0.44) SMN1; SMN2
SCHEMBL8828463 0.87 — —
Hydrochloric Acid SCHEMBL8828598 0.86 PKM (0.40) DRD2
Hydrochloric Acid SCHEMBL8828500 0.86 — —
Hydrochloric Acid SCHEMBL8828816 0.85 DRD2 (0.37) DRD2
Hydrochloric Acid SCHEMBL8828678 0.84 — —
SCHEMBL8828713 0.82 — —
Hydrochloric Acid SCHEMBL8828582 0.82 RPS6KB1 (0.38) SMN1; SMN2DRD2
SCHEMBL8828603 0.81 DRD2 (0.43) DRD2

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-5688795-A URINARY TRACTS OBSTRUCTION SYNTEX (U.S.A.) INC. (US) 1997-11-18 — — US disclosed
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