SCHEMBL7688003

SCHEMBL7688003

Cc1ccc(C2CC(=O)c3c(C)ccnc3C2)s1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35

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
SCHEMBL7689543 0.87
Hydrochloric Acid SCHEMBL27523027 0.83
SCHEMBL7690438 0.80 ADORA2A (0.50)
SCHEMBL7680990 0.76 HSP90AA1 (0.35) HSP90AA1HSP90AB1
SCHEMBL7680967 0.76 HSP90AA1 (0.35) HSP90AA1HSP90AB1
SCHEMBL7690434 0.75
SCHEMBL7683162 0.75 HSP90AA1 (0.42) HSP90AA1HSP90AB1
SCHEMBL27523065 0.74
SCHEMBL7685123 0.74 HSP90AA1 (0.41) HSP90AA1HSP90AB1
SCHEMBL7683315 0.74 ALPL (0.60) HSP90AA1HSP90AB1

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
US-6350749-B1 SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-02-26 US disclosed
EP-1057812-A1 AMINOGUANIDINE HYDRAZONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-12-06 EP disclosed