SCHEMBL11148341

SCHEMBL11148341

CC(=O)Nc1nc2ccc(O)cc2n1S(=O)(=O)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 3/20 0.46
▸ POLB P06746 2/20 0.42
▸ DYRK1A Q13627 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SULT1A1 P50225 1/20 0.37
▸ TYR P14679 1/20 0.36
▸ HTT P42858 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ KCNJ11 Q14654 1/20 0.36
▸ TNF P01375 1/20 0.36
▸ PIK3CA P42336 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL11148006 0.83 NOD1 (0.42) NOD1POLBSMN1; SMN2CYP1A2CYP2C9
SCHEMBL11251402 0.80 SMN1; SMN2 (0.49) NOD1POLBSMN1; SMN2CYP1A2CYP2C9
SCHEMBL11149114 0.78 MAPK14 (0.47) NOD1SMN1; SMN2HTTKDM4EGAA
SCHEMBL11256125 0.76 NOD1 (0.42) NOD1POLBSMN1; SMN2CYP1A2CYP2C9
SCHEMBL11148594 0.75 NOD1 (0.42) NOD1POLBSMN1; SMN2
SCHEMBL11248311 0.75 NOD1 (0.42) NOD1POLBSMN1; SMN2CYP1A2CYP2C9
SCHEMBL5351831 0.69 CYP1A2 (0.75) NOD1POLBSMN1; SMN2CYP1A2CYP2C9
SCHEMBL11148665 0.67 SMN1; SMN2 (0.44) NOD1SMN1; SMN2HTTKDM4EGAA
SCHEMBL24329592 0.64 MEN1 (0.51) NOD1POLBDYRK1ASMN1; SMN2CYP1A2
SCHEMBL11246875 0.64 PI4KB (0.46) NOD1POLBSMN1; SMN2LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4401817-A ANTIVIRAL AGENTS ELI LILLY AND COMPANY (US) 1983-08-30 — — US disclosed
US-4338329-A COMBATTING RHINOVIRUSES ELI LILLY AND COMPANY (US) 1982-07-06 — — US disclosed
US-4289782-A PARTICULARLY FOR INHIBITING GROWTH OF RHINOVIRUSES ELI LILLY AND COMPANY (US) 1981-09-15 — — US disclosed
US-4230868-A α-Alkyl-α-hydroxybenzyl-substituted 1-sulfonylbenzimidazoles ELI LILLY AND COMPANY (US) 1980-10-28 — — US disclosed
US-4174454-A VIRICIDES ELI LILLY AND COMPANY (US) 1979-11-13 — — US disclosed
US-4118742-A VIRICIDES ELI LILLY AND COMPANY (US) 1978-10-03 — — US disclosed
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