SCHEMBL11056340

SCHEMBL11056340

Cc1onc(-c2ccccc2)c1-c1[nH]c2ccccc2c1C(=O)C(=O)N1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.49
HTT P42858 2/20 0.49
GAA P10253 1/20 0.47
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 1/20 0.46
MAPT P10636 2/20 0.46
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL11051497 0.91 TSHR (0.55) KMT2ASMN1; SMN2HTTGAAMEN1
SCHEMBL10983498 0.84 GAA (0.47) KMT2ASMN1; SMN2GAAMEN1LMNA
SCHEMBL10981870 0.83 GAA (0.47) KMT2ASMN1; SMN2GAAMEN1LMNA
SCHEMBL11054892 0.82 KMT2A (0.51) KMT2AHTTGAAMEN1LMNA
SCHEMBL10832448 0.81 KMT2A (0.53) KMT2AHTTGAAMEN1LMNA
SCHEMBL10832100 0.81 ALDH1A1 (0.50) KMT2AHTTMEN1LMNAMAPT
SCHEMBL10924368 0.80 KMT2A (0.47) KMT2ASMN1; SMN2HTTMAPTKDM4E
SCHEMBL10922854 0.79 KMT2A (0.48) KMT2ASMN1; SMN2HTTMEN1LMNA
SCHEMBL10979812 0.76 GAA (0.46) KMT2ASMN1; SMN2HTTGAAMEN1
SCHEMBL10952008 0.75 MAPT (0.44) KMT2ASMN1; SMN2HTTMEN1LMNA

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-4453001-A ANTIDIABETIC AGENTS SANDOZ, INC. (US) 1984-06-05 US disclosed
US-4415568-A ANTIDIABETIC AND HYPOGLYCEMIC AGENTS SANDOZ, INC. (US) 1983-11-15 US disclosed
US-4336378-A ANTIDIABETIC AGENTS SANDOZ, INC. (US) 1982-06-22 US disclosed