SCHEMBL9804186

SCHEMBL9804186

O=C(c1cc2ccccc2cc1O)N(OCCO)OCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ CASP1 P29466 1/20 0.50
▸ CASP7 P55210 1/20 0.50
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ GAA P10253 2/20 0.47
▸ MITF O75030 1/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MAPK1 P28482 3/20 0.42
▸ USP2 O75604 1/20 0.42
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ POLB P06746 1/20 0.40
▸ APOBEC3A P31941 1/20 0.40
▸ APOBEC3G Q9HC16 1/20 0.40

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
SCHEMBL10490463 0.76 SMN1; SMN2 (0.60) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL9804179 0.76 MAPT (0.54) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL28629402 0.72 GAA (0.47) MAPTKDM4EALDH1A1MEN1KMT2A
Ethylene Glycol SCHEMBL28017254 0.72 MAPT (0.60) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL23640265 0.71 HSP90AA1 (0.54) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL11776057 0.70 SMN1; SMN2 (0.56) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL11683390 0.70 KMT2A (0.46) MAPTKDM4EALDH1A1CASP1CASP7
1,4-Butanediol SCHEMBL11776052 0.69 MAPT (0.57) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL28232547 0.69 MEN1 (0.54) MAPTKDM4EALDH1A1CASP1CASP7
SCHEMBL14328976 0.69 MAPT (0.50) MAPTKDM4EALDH1A1CASP1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153616-B1 HEAT-SENSITIVE RECORDING MATERIALS KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-04-03 — — EP disclosed
US-4659643-A A PHENOXY COMPOUND KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-04-21 — — US disclosed
US-4652512-A DIAZONIUM COMPOUND KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1987-03-24 — — US disclosed
EP-0153616-A2 Heat-sensitive recording materials KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1985-09-04 — — EP disclosed
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