SCHEMBL19494477

SCHEMBL19494477

NC(=O)c1cc(SN2CCOCC2)sc1NC(=O)c1cc[nH]n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.35
▸ ALDH1A1 P00352 6/20 0.35
▸ HSD17B10 Q99714 4/20 0.35
▸ USP2 O75604 3/20 0.35
▸ ALOX15 P16050 3/20 0.35
▸ CFTR P13569 1/20 0.35
▸ KDM4E B2RXH2 6/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TBK1 Q9UHD2 1/20 0.33
▸ HPGD P15428 3/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ TNIK Q9UKE5 1/20 0.33
▸ WNT3A P56704 1/20 0.32
▸ CHEK1 O14757 2/20 0.32

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
SCHEMBL19494498 0.91 CFTR (0.40) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494701 0.81 IKBKE (0.40) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494492 0.81 ALDH1A1 (0.39) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494640 0.80 IRAK4 (0.43) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL16263645 0.80 CFTR (0.55) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494684 0.78 NPC1 (0.46) MAPTALDH1A1HSD17B10USP2KDM4E
SCHEMBL19494339 0.77 MAPT (0.38) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494588 0.77 MAPT (0.47) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL16246391 0.77 CFTR (0.56) MAPTALDH1A1HSD17B10USP2ALOX15
SCHEMBL19494391 0.76 IKBKB (0.34) MAPTALDH1A1HSD17B10USP2ALOX15

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-2994463-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS GALAPAGOS NV (BE) 2017-10-25 — — EP disclosed
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