SCHEMBL11304223

SCHEMBL11304223

NNC(=O)C1=Cc2nc(N)n(S(=O)(=O)N3CCCCC3)c2CC1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.32
▸ POLB P06746 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ USP2 O75604 1/20 0.30
▸ NAMPT P43490 1/20 0.30

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
SCHEMBL11206639 0.99 GAA (0.34) L3MBTL1GAATSHRTP53NPSR1
SCHEMBL11305248 0.88 TSHR (0.36) L3MBTL1TSHRTP53NPSR1ALDH1A1
SCHEMBL11312385 0.87 L3MBTL1 (0.34) L3MBTL1TSHRTP53NPSR1
SCHEMBL11307980 0.82 GAA (0.31) GAA
SCHEMBL11227773 0.82 MAPT (0.37) L3MBTL1GAATSHRTP53NPSR1
SCHEMBL11197413 0.79 SMN1; SMN2 (0.32) ALDH1A1KDM4E
SCHEMBL11307320 0.78 — —
SCHEMBL11307840 0.77 TSHR (0.38) GAATSHRALDH1A1POLBKDM4E
SCHEMBL11304955 0.75 — —
SCHEMBL11376616 0.70 NOD1 (0.33) L3MBTL1GAATSHRTP53NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4316021-A VIRICIDES ELI LILLY AND COMPANY (US) 1982-02-16 — — US disclosed
US-4243813-A VIRICIDES ELI LILLY AND COMPANY (US) 1981-01-06 — — US disclosed
US-4196125-A VIRICIDES ELI LILLY AND COMPANY (US) 1980-04-01 — — US disclosed
US-4118573-A ANTIVIRAL AGENTS ELI LILLY AND COMPANY (US) 1978-10-03 — — US disclosed
US-4018790-A VIRICIDES ELI LILLY AND COMPANY (US) 1977-04-19 — — US disclosed
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