SCHEMBL11347017

SCHEMBL11347017

O=C(O)Oc1cnc(=O)n2c1sc1cc(Cl)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 2/20 0.36
▸ PARP2 Q9UGN5 2/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ PDE11A Q9HCR9 2/20 0.35
▸ MAPT P10636 4/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ CYP1A1 P04798 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ KMO O15229 2/20 0.32
▸ BCKDK O14874 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ CCNC P24863 2/20 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
SCHEMBL11359829 0.86 PARP10 (0.44) PARP15PARP2TNKS2POLBSMN1; SMN2
SCHEMBL11418009 0.86 KDM4E (0.36) SMN1; SMN2PDE11AMAPTRAB9ANPC1
SCHEMBL11346930 0.84 ALDH1A1 (0.47) PARP15PARP2TNKS2SMN1; SMN2PDE11A
SCHEMBL11419156 0.83 NPC1 (0.33) PARP2SMN1; SMN2PDE11AMAPTRAB9A
SCHEMBL11409814 0.83 CYP2C19 (0.33) SMN1; SMN2PDE11AMAPTRAB9ANPC1
SCHEMBL11345987 0.83 PARP15 (0.39) PARP15PARP2TNKS2SMN1; SMN2PDE11A
SCHEMBL11346879 0.83 PDE1B (0.41) POLBSMN1; SMN2PDE11AMAPTRAB9A
SCHEMBL11347014 0.81 SMN1; SMN2 (0.39) PARP15PARP2TNKS2POLBSMN1; SMN2
SCHEMBL11595245 0.81 NPC1 (0.41) RAB9ANPC1
SCHEMBL11352934 0.80 STING1 (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-0005154-B1 1-OXO-1H-PYRIMIDO (6,1-B) BENZOTHIAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Roche Diagnostics GmbH (DE) 1981-11-25 — — EP disclosed
EP-0005154-A1 1-Oxo-1H-pyrimido (6,1-b) benzothiazole derivatives, processes for their preparation and pharmaceutical compositions containing them Roche Diagnostics GmbH (DE) 1979-11-14 — — EP disclosed
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