SCHEMBL10486754

SCHEMBL10486754

CC(CNS(=O)(=O)NCC(C)C(C)(C)C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.37
CA7 P43166 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA9 Q16790 2/20 0.37
CA1 P00915 2/20 0.35
CA2 P00918 1/20 0.32
GRIA4 P48058 2/20 0.32
GRIA1 P42261 3/20 0.30

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
SCHEMBL12898950 0.83 GRIA4 (0.46) GRIA4
SCHEMBL12898957 0.81 GRIA4 (0.47) GRIA4GRIA1
SCHEMBL10893531 0.71 CA12 (0.35) CA12CA7CA14CA9CA1
SCHEMBL21588719 0.67
SCHEMBL17885764 0.65 GRIA4 (0.36) GRIA4GRIA1
SCHEMBL12978406 0.65 LMNA (0.34)
SCHEMBL20691899 0.65 TSHR (0.31)
SCHEMBL22457462 0.63 CA12 (0.35) CA12CA7CA14CA9
SCHEMBL13779167 0.63 MTNR1A (0.39)
SCHEMBL13918161 0.63 MTNR1A (0.39)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4831096-A VARYING THERMAL STABILITIES PENNWALT CORPORATION (US) 1989-05-16 US disclosed
US-4604455-A REACTING TWO PRIMARY AMINES WITH SULFURYL CHLORIDE, OXIDIZING MIXTURE OF SULFAMIDE PRODUCTS PENNWALT CORPORATION (US) 1986-08-05 US disclosed
US-4585857-A HIGH YIELD AND PURITY PENNWALT CORPORATION (US) 1986-04-29 US disclosed