SCHEMBL6618488

SCHEMBL6618488

CCCC(C)CCNC1=NS(=O)(=O)c2cnccc2N1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 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
SCHEMBL6618114 0.89 UTS2R (0.32) ALDH1A1LMNAMAPTCA12CA1
Water SCHEMBL8623502 0.87 KDM4C (0.38) ALDH1A1LMNACA12CA1CA2
SCHEMBL8626608 0.85 KDM6B (0.41) ALDH1A1LMNACA12CA1CA2
SCHEMBL6618893 0.83 LATS1 (0.40) LMNA
SCHEMBL6619663 0.83 LATS1 (0.40) LMNA
SCHEMBL8623804 0.82 KDM6B (0.40) ALDH1A1LMNACA12CA1CA2
SCHEMBL4264934 0.78 LATS1 (0.40) ALDH1A1LMNACA12CA1CA2
SCHEMBL8626480 0.77 CA12 (0.36) ALDH1A1LMNACA12CA1CA2
SCHEMBL7083730 0.76 KDM6B (0.44) ALDH1A1MAPTMAPK1
SCHEMBL8717642 0.75 GAA (0.33) MAPT

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
EP-0877748-B1 PYRIDO-1,2,4-THIADIAZINE AND PYRIDO-1,4-THIAZINE DERIVATIVES, THEIR PREPARATION AND USE UNIV LIEGE (BE) 2004-11-03 EP disclosed
US-5792764-A ENDOCRINE DISORDERS ESPECIALLY AS A K(ATP)-CHANNEL MODULATOR NOVO NORDISK A/S (DK) 1998-08-11 US disclosed