SCHEMBL11137198

SCHEMBL11137198

COc1ccc(OC)c(-c2csc(NC(=O)C(=O)O)n2)c1

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 13/20 0.70
▸ MEN1 O00255 11/20 0.69
▸ MAPT P10636 9/20 0.69
▸ SMN1; SMN2 Q16637 3/20 0.69
▸ HTT P42858 1/20 0.69
▸ NPC1 O15118 1/20 0.68
▸ LMNA P02545 4/20 0.66
▸ MAPK1 P28482 1/20 0.64
▸ KDM4E B2RXH2 2/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ RXFP1 Q9HBX9 1/20 0.57

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
SCHEMBL11139020 0.91 CSNK2A1 (0.66) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11140681 0.87 TYR (0.58) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11137393 0.84 HPGDS (0.64) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11134270 0.83 KMT2A (0.53) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11144373 0.81 KMT2A (0.61) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11137982 0.81 MEN1 (0.70) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11138002 0.81 MEN1 (0.77) KMT2AMEN1MAPTNPC1LMNA
SCHEMBL5046651 0.80 KMT2A (0.80) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL11137552 0.80 ALDH1A1 (0.78) KMT2AMEN1MAPTSMN1; SMN2HTT
SCHEMBL16607144 0.79 KMT2A (0.78) KMT2AMEN1MAPTSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4407810-A TREATMENT OF ALLERGIC DISORDERS BASF AKTIENGESELLSCHAFT (DE) 1983-10-04 — — US disclosed
EP-0044442-A1 N-(4-Phenyl-2-thiazolyl)-oxamidic-acid-2-ethoxyethylester, process for its preparation and pharmaceutical compositions containing this compound BASF Aktiengesellschaft (DE) 1982-01-27 — — EP disclosed
US-4238496-A ANTIALLERGENS BOEHRINGER INGELHEIM GMBH (DE) 1980-12-09 — — US disclosed
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