SCHEMBL7545220

SCHEMBL7545220

CCN(C(N)=O)c1nc2ccc(-c3nn[nH]n3)cc2s1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.45
▸ ITK Q08881 1/20 0.44
▸ PTGDR2 Q9Y5Y4 8/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ XDH P47989 1/20 0.39
▸ TMPRSS15 P98073 2/20 0.38

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
SCHEMBL7539138 0.77 SMN1; SMN2 (0.48) ALDH1A1
SCHEMBL7546022 0.76 MAPT (0.41) ALDH1A1
SCHEMBL7534511 0.76 ALDH1A1 (0.51) ALDH1A1
SCHEMBL7535208 0.76 MAPK1 (0.50) —
SCHEMBL6068038 0.75 LMNA (0.49) —
SCHEMBL27586269 0.74 HSD17B10 (0.64) HSD17B10ITKALDH1A1
SCHEMBL7247636 0.73 DYRK1A (0.51) —
SCHEMBL7534938 0.73 LMNA (0.47) HSD17B10
SCHEMBL31404204 0.72 PI4KA (0.60) HSD17B10
SCHEMBL27034701 0.72 PI4KA (0.60) HSD17B10

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
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