SCHEMBL7869337

SCHEMBL7869337

CCc1nc2c([C@H](CO)N(CC)CC)cccc2cc1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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 SCHEMBL7869367 0.99 MEN1 (0.30) MEN1KMT2A
SCHEMBL7774855 0.87 KMT2A (0.38) MEN1KMT2A
SCHEMBL7210617 0.81 PDE10A (0.43) MEN1KMT2A
SCHEMBL7877946 0.81 KMT2A (0.33) MEN1KMT2A
SCHEMBL7781780 0.81 KMT2A (0.33) MEN1KMT2A
SCHEMBL7781783 0.81 KMT2A (0.33) MEN1KMT2A
SCHEMBL7774838 0.79
SCHEMBL7869318 0.79
SCHEMBL7210585 0.78 MBNL1 (0.47)
SCHEMBL7997535 0.77 CYP1A2 (0.41) MEN1KMT2A

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-6331549-B1 TREATMENT OF URINARY STRESS INCONTINENCE, VENOUS INSUFFICIENCY, VENOUS ULCERS, MIGRAINE OR GASTROINTESTINAL DISORDERS SANOFI-SYNTHELABO (FR) 2001-12-18 US claimed
US-6331549-B1 TREATMENT OF URINARY STRESS INCONTINENCE, VENOUS INSUFFICIENCY, VENOUS ULCERS, MIGRAINE OR GASTROINTESTINAL DISORDERS SANOFI-SYNTHELABO (FR) 2001-12-18 US disclosed