SCHEMBL11229501

SCHEMBL11229501

O=S(=O)(O)c1cccc2oc(-c3ccccc3)nc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RCE1 Q9Y256 1/20 0.64
▸ TOP2A P11388 1/20 0.48
▸ PTPN1 P18031 12/20 0.43
▸ PTPN5 P54829 12/20 0.43
▸ HSPD1 P10809 3/20 0.43
▸ HSPE1 P61604 3/20 0.43
▸ PTPN2 P17706 11/20 0.42
▸ RAB9A P51151 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ HTR3A P46098 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL19499377 0.84 RCE1 (0.53) RCE1TOP2APTPN1PTPN5HSPD1
SCHEMBL5051762 0.80 TOP2A (0.59) RCE1TOP2APTPN1PTPN5HSPD1
SCHEMBL121325 0.80 TOP2A (0.65) RCE1TOP2ARAB9ASMN1; SMN2HIF1A
SCHEMBL28558754 0.77 CYP2C9 (0.51) RCE1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL27798862 0.76 TTR (0.42) RCE1HTR3AHSD17B10ALDH1A1HTR6
SCHEMBL7907329 0.76 HTR6 (0.39) RCE1HTR6
SCHEMBL11230129 0.76 RCE1 (0.38) RCE1HTR6
SCHEMBL56593 0.76 TOP2A (0.53) RCE1TOP2APTPN1PTPN5HSPD1
SCHEMBL28868160 0.76 TOP2A (0.47) RCE1TOP2APTPN1PTPN5PTPN2
SCHEMBL28926584 0.74 TOP2A (0.59) RCE1TOP2ARAB9ASMN1; SMN2MEN1

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-0012178-B1 BENZOXAZOL DERIVATIVES, METHODS FOR THEIR PREPARATION, COSMETIC COMPOSITIONS CONTAINING SUCH COMPOUNDS, USE OF SUCH COMPOUNDS AS UV-A FILTERS AND METHOD OF PROTECTING THE SKIN AND HAIR AND METHOD OF STABILIZING COSMETIC COMPOSITIONS Richardson-Vicks, Inc. (US) 1982-12-08 — — EP disclosed
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