SCHEMBL19984830

SCHEMBL19984830

COc1ccccc1-c1nnc(CNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)o1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.67
POLB P06746 2/20 0.67
PKM P14618 6/20 0.55
THRB P10828 3/20 0.51
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
IDO1 P14902 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
SCHEMBL19984829 0.79 LMNA (0.50) LMNAPOLBPKMTHRBMEN1
SCHEMBL19984828 0.73 TP53 (0.47) LMNAMEN1KMT2A
SCHEMBL10154069 0.66 PKM (0.66) LMNAPOLBPKMTHRBMEN1
SCHEMBL19984993 0.65 PTK2 (0.48) LMNATHRBKMT2A
SCHEMBL19984797 0.64 KMT2A (0.44) LMNATHRBMEN1KMT2A
SCHEMBL19984784 0.64 PTK2 (0.47) LMNATHRBMEN1KMT2A
SCHEMBL29411450 0.64 PKM (0.66) LMNAPOLBPKMTHRBMEN1
SCHEMBL21045103 0.64 PKM (0.66) LMNAPOLBPKMTHRBMEN1
SCHEMBL13073875 0.64 PTK2 (0.59) LMNATHRBMEN1KMT2A
SCHEMBL19984808 0.64 EGFR (0.50) LMNATHRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018051255-A1 CYCLIC SUBSTITUTED-1,3,4-OXADIAZOLE AND THIADIAZOLE COMPOUNDS AS IMMUNOMODULATORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-03-22 WO disclosed