SCHEMBL4078210

SCHEMBL4078210

OCCCNc1nc(-c2ccc(Br)cc2)cs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.60
ALDH1A1 P00352 8/20 0.60
MEN1 O00255 8/20 0.60
KMT2A Q03164 8/20 0.60
NPSR1 Q6W5P4 1/20 0.60
RAB9A P51151 10/20 0.53
NPC1 O15118 9/20 0.53
STAT1 P42224 1/20 0.53
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
LMNA P02545 6/20 0.47
ALOX12 P18054 2/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GAA P10253 6/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
KDM4E B2RXH2 3/20 0.46

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
SCHEMBL3523965 0.82 MAPT (0.64) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL3976858 0.77 NPC1 (0.56) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL13192815 0.77 MAPT (0.59) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL4075234 0.77 MEN1 (0.68) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL10352100 0.76 MAPT (0.67) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL14468806 0.75 MAPT (0.77) MAPTALDH1A1MEN1KMT2ANPSR1
Hydrochloric Acid SCHEMBL10352099 0.75 MAPT (0.65) MAPTALDH1A1MEN1KMT2ARAB9A
SCHEMBL4487938 0.74 GAA (0.61) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL2255388 0.74 MAPT (0.60) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL8171460 0.73 MAPT (0.74) MAPTALDH1A1MEN1KMT2ANPSR1

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-2054410-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS Wyeth (US) 2009-05-06 EP disclosed
WO-2008021331-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS WYETH (US) 2008-02-21 WO disclosed