SCHEMBL11054892

SCHEMBL11054892

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

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MAPT P10636 4/20 0.51
MEN1 O00255 3/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
PTGS2 P35354 3/20 0.48
PTGS1 P23219 1/20 0.48
NPSR1 Q6W5P4 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
GAA P10253 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 1/20 0.42
MT-CO2 P00403 2/20 0.42

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
SCHEMBL11049245 0.91 PADI4 (0.45) KMT2AMAPTMEN1LMNAHTT
SCHEMBL11054385 0.89 CSF1R (0.46) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10832448 0.87 KMT2A (0.53) KMT2AMAPTMEN1LMNAHTT
SCHEMBL11046939 0.87 TUBB4A (0.48) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10832100 0.87 ALDH1A1 (0.50) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10986559 0.86 KCNH2 (0.44) KMT2AMAPTMEN1LMNAHTT
SCHEMBL11056340 0.82 KMT2A (0.53) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10983506 0.82 KMT2A (0.37) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10977881 0.82 KMT2A (0.37) KMT2AMAPTMEN1LMNAHTT
SCHEMBL10982497 0.82 ALDH1A1 (0.41) KMT2AMAPTMEN1LMNAHTT

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