SCHEMBL7540486

SCHEMBL7540486

CCN(C(N)=O)c1nc2c(s1)C(Sc1ccccc1)(Sc1ccccc1)CCC2

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC27A1 Q6PCB7 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
POLQ O75417 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
SCHEMBL7540482 0.73 MTNR1A (0.34) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL7545430 0.70 ALOX5 (0.32) SLC27A1MEN1KMT2A
SCHEMBL7540660 0.66 ALDH1A1 (0.48) SLC27A1ALDH1A1MAPT
SCHEMBL7536844 0.65 SIRT1 (0.38) LMNAMEN1ALDH1A1KMT2A
SCHEMBL1842323 0.64 NPC1 (0.52) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL7601537 0.63 TGFBR1 (0.35) SLC27A1ALDH1A1
Hydrochloric Acid SCHEMBL1844041 0.63 NPC1 (0.51) LMNAMEN1ALDH1A1MAPTKMT2A
SCHEMBL7588936 0.60 KMT2A (0.40) LMNAMEN1ALDH1A1KMT2A
SCHEMBL11359838 0.59 ALOX15 (0.39) SLC27A1LMNAMEN1ALDH1A1MAPT
SCHEMBL340272 0.58 ALDH1A1 (0.70) MEN1ALDH1A1KMT2A

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-1254123-A1 2-BENZOTHIAZOLYL UREA DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS Abbott GmbH & Co. KG (DE) 2002-11-06 EP disclosed
WO-2001057008-A1 2-BENZOTHIAZOLYL UREA DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS ABBOTT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG & COMPANY KOMMANDITGESELLSCHAFT (DE) 2001-08-09 WO disclosed