SCHEMBL9480490

SCHEMBL9480490

Oc1ccc(SCC(O)COc2ccccc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.80
KMT2A Q03164 2/20 0.55
HSD17B10 Q99714 1/20 0.55
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.46
CYP2D6 P10635 4/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
HIF1A Q16665 3/20 0.45
SLC6A2 P23975 2/20 0.45
MEN1 O00255 1/20 0.45
CYP1A2 P05177 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
DRD1 P21728 1/20 0.45
SLC6A4 P31645 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL9770465 0.94 BACE1 (0.76) BACE1KMT2AHSD17B10NPC1RAB9A
SCHEMBL9770570 0.92 BACE1 (0.76) BACE1KMT2AHSD17B10NPC1RAB9A
SCHEMBL9770321 0.91 BACE1 (0.76) BACE1KMT2AHSD17B10NPC1RAB9A
SCHEMBL3131341 0.89 BACE1 (0.64) BACE1KMT2AHSD17B10NPC1RAB9A
SCHEMBL9770389 0.88 BACE1 (0.64) BACE1KMT2AHSD17B10
SCHEMBL9770232 0.88 BACE1 (0.64) BACE1KMT2AHSD17B10LMNAL3MBTL1
SCHEMBL9770536 0.87 BACE1 (0.62) BACE1KMT2AHSD17B10NPC1RAB9A
SCHEMBL9770440 0.87 BACE1 (0.70) BACE1KMT2ALMNACYP2D6MEN1
SCHEMBL9770562 0.85 BACE1 (0.67) BACE1KMT2ANPC1RAB9ALMNA
SCHEMBL9770149 0.85 BACE1 (0.67) BACE1KMT2AADRB2ADRB1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5071822-A Electron donating colorless dye, electron accepting derivative of 1-(4-hydroxyphenylthio)-3-oxy-2-propanol; heat sensitive, image stability KAO CORPORATION (JP) 1991-12-10 US claimed
EP-0338587-A2 Recording material KAO CORPORATION (JP) 1989-10-25 EP claimed
JP-2145563-A None JP disclosed
EP-0563392-A1 2-PROPANOL COMPOUND AND RECORDING MATERIAL PREPARED THEREFROM NIPPON SODA CO., LTD. (JP) 1993-10-06 EP disclosed
US-5071822-A Electron donating colorless dye, electron accepting derivative of 1-(4-hydroxyphenylthio)-3-oxy-2-propanol; heat sensitive, image stability KAO CORPORATION (JP) 1991-12-10 US disclosed
JP-H02145563-A PHENOL COMPOUND KAO CORP 1990-06-05 JP disclosed
EP-0338587-A2 Recording material KAO CORPORATION (JP) 1989-10-25 EP disclosed