SCHEMBL19445628

SCHEMBL19445628

C=C(Nc1ccc(OC)c(C(N)=O)c1)[C@H](C)CCCNC(C)=N

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ POLB P06746 3/20 0.37
▸ QPCT Q16769 3/20 0.36
▸ PRNP P04156 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ F2 P00734 2/20 0.35
▸ SYK P43405 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ C5 P01031 1/20 0.35

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
SCHEMBL13973873 0.82 LMNA (0.42) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL19445763 0.81 LMNA (0.40) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL12515235 0.77 LMNA (0.41) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL13815082 0.76 AAK1 (0.44) LMNAMEN1KMT2APOLB
SCHEMBL19445850 0.76 NPC1 (0.42) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL19445682 0.76 SMN1; SMN2 (0.40) LMNAKMT2ASMN1; SMN2POLBKDM4E
SCHEMBL19445573 0.75 LMNA (0.39) LMNAMEN1KMT2ASMN1; SMN2POLB
SCHEMBL15317942 0.73 LMNA (0.46) LMNAMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13973703 0.73 HSD17B10 (0.40) LMNAMEN1KMT2AMAPTKDM4E
SCHEMBL10262220 0.72 ALDH1A1 (0.41) LMNAMEN1KMT2APOLB

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
EP-2709619-B1 COMPOUNDS FOR USE IN TREATMENT OF MUCOSITIS CELLCEUTIX CORP (US) 2017-10-11 — — EP disclosed
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