SCHEMBL6068038

SCHEMBL6068038

CCN(C(N)=O)c1nc2ccc(CN)cc2s1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
TP53 P04637 2/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
UBE2N P61088 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 1/20 0.41

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
SCHEMBL7534938 0.90 LMNA (0.47) LMNATP53NPC1RAB9AKMT2A
SCHEMBL7539138 0.84 SMN1; SMN2 (0.48) LMNATP53NPC1RAB9AKMT2A
SCHEMBL7534511 0.83 ALDH1A1 (0.51) LMNATP53KMT2AMEN1SMN1; SMN2
SCHEMBL7535208 0.83 MAPK1 (0.50) LMNANPC1RAB9AKMT2AMEN1
SCHEMBL7247636 0.80 DYRK1A (0.51) LMNANPC1RAB9A
SCHEMBL1842323 0.80 NPC1 (0.52) LMNATP53NPC1RAB9AKMT2A
SCHEMBL7540147 0.79 KMT2A (0.55) LMNANPC1RAB9AKMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL1844041 0.79 NPC1 (0.51) LMNATP53NPC1RAB9AKMT2A
SCHEMBL7538356 0.78 LMNA (0.41) LMNATP53MAPT
SCHEMBL27566816 0.77 NPC1 (0.44) LMNATP53NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7091227-B2 Benzothiazole derivatives ABBOTT GMBH & CO. KG (DE) 2006-08-15 US disclosed
CN-1422262-A 2-benzothiazolyl urea derivatives and their use as protein kinase inhibitors ABBOTT GMBH & CO KG (DE) 2003-06-04 CN disclosed
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