SCHEMBL11148594

SCHEMBL11148594

CC(=O)Nc1nc2cc(C(=O)NN)ccc2n1S(=O)(=O)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 2/20 0.42
▸ ITK Q08881 4/20 0.39
▸ POLB P06746 2/20 0.38
▸ HDAC6 Q9UBN7 7/20 0.38
▸ STING1 Q86WV6 1/20 0.37
▸ HDAC1 Q13547 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ TP53 P04637 1/20 0.35

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
SCHEMBL11146117 0.84 SMN1; SMN2 (0.39) HDAC6HDAC1SMN1; SMN2RAB9ATP53
SCHEMBL11267605 0.81 NOD1 (0.38) NOD1ITKPOLBSMN1; SMN2RAB9A
SCHEMBL11248311 0.80 NOD1 (0.42) NOD1POLBSMN1; SMN2
SCHEMBL11256125 0.79 NOD1 (0.42) NOD1POLBSMN1; SMN2
SCHEMBL11148341 0.75 NOD1 (0.46) NOD1POLBSMN1; SMN2
SCHEMBL11251402 0.75 SMN1; SMN2 (0.49) NOD1POLBSMN1; SMN2RAB9ATP53
SCHEMBL11625701 0.74 MAPK14 (0.44) SMN1; SMN2
Water SCHEMBL11149536 0.74 MAPK14 (0.44) SMN1; SMN2
SCHEMBL11248780 0.73 NOD1 (0.38) NOD1POLBSMN1; SMN2RAB9A
SCHEMBL11148006 0.72 NOD1 (0.42) NOD1POLBSMN1; SMN2RAB9A

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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