SCHEMBL7757291

SCHEMBL7757291

O=C(SN1CCOCC1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
PHGDH O43175 1/20 0.50
HPGD P15428 1/20 0.50
MAPT P10636 5/20 0.49
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 4/20 0.45
HSD17B10 Q99714 1/20 0.45
KMO O15229 1/20 0.45
POLB P06746 2/20 0.44
HTT P42858 2/20 0.44
MEN1 O00255 1/20 0.44
CASP3 P42574 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
ATM Q13315 1/20 0.44
HIF1A Q16665 1/20 0.44

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
SCHEMBL10975873 0.78 PHGDH (0.57) PHGDHHPGDMAPTKMT2AALDH1A1
SCHEMBL610091 0.73 HPGD (0.60) TSHRPHGDHHPGDMAPTKMT2A
SCHEMBL6577673 0.72 GRIA3 (0.51) TSHRPHGDHHPGDMAPTKMT2A
SCHEMBL9772355 0.72 ALDH1A1 (0.47) TSHRPHGDHHPGDMAPTKMT2A
SCHEMBL10560780 0.72 MGLL (0.48) TSHRPHGDHKMT2AALDH1A1SMN1; SMN2
SCHEMBL946143 0.72 HPGD (0.86) TSHRPHGDHHPGDKMT2AALDH1A1
SCHEMBL30449295 0.70 HPGD (0.83) TSHRPHGDHHPGDKMT2AALDH1A1
Benzoic Acid SCHEMBL11583235 0.70 KMO (0.56) TSHRPHGDHHPGDMAPTKMT2A
Ammonia Solution, Strong SCHEMBL6028542 0.70 HPGD (0.83) TSHRPHGDHHPGDKMT2AALDH1A1
SCHEMBL28948313 0.70 TSHR (0.49) TSHRPHGDHHPGDMAPTKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6294698-B1 ENERGY-EFFICIENT PHOTOINITIATORS IN FORM OF ORGANIC SULFUR-CONTAINING COMPOUNDS KIMBERLY-CLARK WORLDWIDE, INC. 2001-09-25 US disclosed
EP-1080118-A1 NOVEL PHOTOINITIATORS AND APPLICATIONS THEREFOR Kimberly-Clark Worldwide, Inc. (US) 2001-03-07 EP disclosed
WO-1999054363-A1 NOVEL PHOTOINITIATORS AND APPLICATIONS THEREFOR KIMBERLY-CLARK WORLDWIDE, INC. (US) 1999-10-28 WO disclosed