SCHEMBL8306896

SCHEMBL8306896

O=C1NC(=O)C(Sc2ccccn2)S1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.50
DDB1 Q16531 2/20 0.50
CA2 P00918 1/20 0.40
EHMT2 Q96KQ7 1/20 0.40
EHMT1 Q9H9B1 1/20 0.40
APOBEC3G Q9HC16 1/20 0.40
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 3/20 0.36
PPARG P37231 3/20 0.36
TSHR P16473 1/20 0.35
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
PKM P14618 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
SCHEMBL8307240 0.80 CRBN (0.45) CRBNDDB1CA2KDM4EALDH1A1
SCHEMBL8307313 0.76 GAA (0.37) CRBNDDB1CA2KDM4EALDH1A1
SCHEMBL8304222 0.75 CA2 (0.50) CRBNDDB1CA2KDM4ETDP1
SCHEMBL5363965 0.69 CRBN (0.74) CRBNDDB1EHMT2EHMT1APOBEC3G
SCHEMBL16285284 0.67 EHMT2 (0.45) CRBNDDB1EHMT2EHMT1APOBEC3G
SCHEMBL22612114 0.67 CRBN (1.00) CRBNDDB1
SCHEMBL6754034 0.66 CRBN (0.47) CRBNDDB1CA2KDM4ETDP1
SCHEMBL1249983 0.66 PPARG (0.51) KDM4ETDP1PPARGMAPT
SCHEMBL8302470 0.65 CA2 (0.39) CRBNDDB1CA2KDM4ETDP1
SCHEMBL18283225 0.64 CRBN (0.51) CRBNDDB1EHMT2EHMT1APOBEC3G

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
EP-0749430-B1 THIAZOLIDINEDIONE DERIVATIVES AS ANTI-HYPERGLYCEMIC AGENTS AMERICAN HOME PROD (US) 1999-08-25 EP disclosed
US-5605918-A SUBSTITUTED THIAZOLIDINE-2,4-DIONES AMERICAN HOME PRODUCTS CORPORATION (US) 1997-02-25 US disclosed
EP-0749430-A1 THIAZOLIDINEDIONE DERIVATIVES AS ANTI-HYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1996-12-27 EP disclosed
US-5574051-A HYPOGLYCEMIC AMERICAN HOME PRODUCTS CORPORATION (US) 1996-11-12 US disclosed
WO-1995024400-A1 THIAZOLIDINEDIONE DERIVATIVES AS ANTI-HYPERGLYCEMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1995-09-14 WO disclosed