SCHEMBL19090236

SCHEMBL19090236

C=C1NC(=O)N(Cc2ccc(I)cc2)c2nc(COc3cc4c(nn3)CCC(C)C4)n(CC)c21

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.34

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
SCHEMBL19090235 0.78 KMT2A (0.44) —
SCHEMBL21389505 0.71 BRD4 (0.46) —
SCHEMBL19090462 0.65 P2RX3 (0.35) LMNA
SCHEMBL19090395 0.65 ADAMTS5 (0.35) LMNA
SCHEMBL19090465 0.65 MEN1 (0.39) LMNA
SCHEMBL19090394 0.64 P2RX3 (0.34) —
SCHEMBL19090459 0.64 MEN1 (0.49) —
SCHEMBL19090407 0.62 P2RX3 (0.36) —
SCHEMBL19090597 0.62 ALDH1A1 (0.45) —
SCHEMBL19090326 0.61 NPSR1 (0.47) LMNA

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-2017114843-A1 XANTHINE DERIVATIVE INHIBITORS OF BET PROTEINS INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2017-07-06 — — WO disclosed
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