SCHEMBL6948425

SCHEMBL6948425

NCc1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
LOXL2 Q9Y4K0 3/20 0.34
KEAP1 Q14145 1/20 0.34
KCNN4 O15554 2/20 0.33
KCNA3 P22001 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HSP90AA1 P07900 1/20 0.33
KIF11 P52732 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
SLC22A1 O15245 1/20 0.33
NR1I2 O75469 1/20 0.33
GMNN O75496 1/20 0.33
USP2 O75604 1/20 0.33
TRPM2 O94759 1/20 0.33
ABCB11 O95342 1/20 0.33
EGFR P00533 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL9229669 0.84 KMT2A (0.39) KMT2AMEN1CYP11B1CYP11B2KIF11
SCHEMBL647893 0.83 KMT2A (0.46) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL8188378 0.83 KMT2A (0.46) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL1845371 0.83 KMT2A (0.43) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL6467815 0.83 KMT2A (0.43) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL5327785 0.83 KMT2A (0.43) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL22832794 0.82 KMT2A (0.40) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL8806580 0.80 KMT2A (0.44) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL27544681 0.80 KMT2A (0.41) KMT2AMEN1CYP11B1CYP11B2KCNN4
SCHEMBL1528022 0.80 KMT2A (0.44) KMT2AMEN1CYP11B1CYP11B2KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1311292-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS Bristol-Myers Squibb Pharma Company (US) 2003-05-21 EP disclosed
WO-2001097861-A2 VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO disclosed
US-5397798-A Benzamide and sulfonamide hypoglycemic agents ELI LILLY AND COMPANY (US) 1995-03-14 US disclosed
EP-0491525-A1 Benzamide and sulfonamide hypoglycemic agents ELI LILLY AND COMPANY (US) 1992-06-24 EP disclosed