SCHEMBL6849716

SCHEMBL6849716

Cc1cc2c(=O)nc(Nc3ccc(Oc4ccccc4)cc3)oc2s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ RAF1 P04049 1/20 0.41
▸ BRAF P15056 1/20 0.41
▸ KDR P35968 1/20 0.40
▸ TEK Q02763 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PIN1 Q13526 2/20 0.39
▸ ELANE P08246 2/20 0.38
▸ RIPK2 O43353 1/20 0.38
▸ EGFR P00533 1/20 0.38

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
SCHEMBL4259210 0.82 MAPT (0.46) NPC1RAB9ARAF1BRAFALDH1A1
SCHEMBL13891521 0.78 ELANE (0.47) NPC1RAB9ARAF1BRAFKDR
SCHEMBL3452438 0.72 C1R (0.55) NPC1RAB9ARAF1BRAFALDH1A1
SCHEMBL3452122 0.71 C1R (0.63) NPC1RAB9ARAF1BRAFALDH1A1
SCHEMBL4268146 0.71 ELANE (0.47) NPC1RAB9ARAF1BRAFKDR
SCHEMBL4259446 0.71 C1R (0.46) NPC1RAB9ARAF1BRAFALDH1A1
SCHEMBL4263278 0.70 ELANE (0.46) NPC1RAB9ARAF1BRAFKDR
SCHEMBL4258175 0.70 ELANE (0.46) NPC1RAB9ARAF1BRAFKDR
SCHEMBL3453188 0.70 ELANE (0.76) NPC1RAB9AKDRTEKALDH1A1
SCHEMBL4258656 0.70 ELANE (0.43) NPC1RAB9ARAF1BRAFKDR

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-1446125-A1 THIENO-(1,3)-OXAZIN-4-ONES WITH LIPASE INHIBITING ACTIVITY Alizyme Therapeutics Limited (GB) 2004-08-18 — — EP claimed
WO-2003020282-A1 THIENO-(1,3)-OXAZIN-4-ONES WITH LIPASE INHIBITING ACTIVITY ALIZYME THERAPEUTICS LIMITED (GB) 2003-03-13 — — WO claimed
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