SCHEMBL7489244

SCHEMBL7489244

NC(=O)[CH]CCn1cccc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.37
TSHR P16473 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
Urea SCHEMBL27857769 0.70 TP53 (0.41) TP53TSHRHPGDMEN1KMT2A
SCHEMBL6333046 0.70 LMNA (0.44) TP53TSHRHPGDMEN1KMT2A
SCHEMBL4027334 0.70 LMNA (0.46) MEN1KMT2A
SCHEMBL7866581 0.68 TP53 (0.39) TP53TSHRHPGDMEN1KMT2A
SCHEMBL6159422 0.64
SCHEMBL1259804 0.64
SCHEMBL2214936 0.64
SCHEMBL5090054 0.64 LTA4H (0.42) TP53TSHRHPGDKMT2A
SCHEMBL27512119 0.64 LTA4H (0.42) TP53TSHRHPGDKMT2A
SCHEMBL27910344 0.63 TP53 (0.53) TP53TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261601-A1 SUBSTITUTED INDOLES FOR MODULATING NFKB ACTIVITY Aventis Pharma Deutschland GmbH (DE) 2002-12-04 EP disclosed
WO-2001030774-A1 SUBSTITUTED INDOLES FOR MODULATING NFKB ACTIVITY AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-05-03 WO disclosed