SCHEMBL8828522

SCHEMBL8828522

CCCNc1nc(N2CCN(c3ccccc3OC)CC2)ccc1C(=O)N(C)C

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47

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 SCHEMBL8828512 0.99 — —
Hydrochloric Acid SCHEMBL8828559 0.92 NPC1 (0.45) NPC1RAB9A
Hydrochloric Acid SCHEMBL8828692 0.91 NPC1 (0.46) NPC1RAB9A
Hydrochloric Acid SCHEMBL8828689 0.89 — —
Hydrochloric Acid SCHEMBL8828639 0.88 — —
Hydrochloric Acid SCHEMBL8828578 0.88 — —
Hydrochloric Acid SCHEMBL8828766 0.88 — —
SCHEMBL8828722 0.87 HSD11B1 (0.41) —
SCHEMBL8828535 0.87 NPC1 (0.45) NPC1RAB9A
Hydrochloric Acid SCHEMBL8828653 0.87 DRD2 (0.44) —

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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