SCHEMBL12044485

SCHEMBL12044485

CCCC(=O)c1c(O)c(O)c(C(=O)CCC)c2c1OCO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 2/20 0.43
▸ HSD17B3 P37058 1/20 0.37
▸ PLA2G2A P14555 2/20 0.37
▸ PLA2G5 P39877 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ ALDH1A1 P00352 7/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ FFAR1 O14842 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ ALOX5 P09917 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33

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
SCHEMBL12044461 0.75 FASN (0.33) FASNHPGD
SCHEMBL9752636 0.74 FASN (0.61) FASNHSD17B3PLA2G2APLA2G5HPGD
SCHEMBL12044490 0.73 CYP3A4 (0.34) HPGDALDH1A1TSHRHSD17B10LMNA
SCHEMBL28460836 0.69 FASN (0.67) FASNHSD17B3PLA2G2APLA2G5HPGD
SCHEMBL10908498 0.67 FASN (0.39) FASNPLA2G2APLA2G5HPGDALDH1A1
SCHEMBL9752842 0.67 FASN (0.75) FASNHSD17B3PLA2G2APLA2G5HPGD
SCHEMBL28920255 0.67 FFAR1 (0.62) FASNHSD17B3PLA2G2APLA2G5HPGD
SCHEMBL10701611 0.66 CTNNB1 (0.52) HPGDALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL9752757 0.65 FASN (0.52) FASNHSD17B3PLA2G2APLA2G5HPGD
SCHEMBL10908511 0.65 FFAR1 (0.72) FASNHSD17B3PLA2G2APLA2G5HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8664410-B2 Fluorescent dye and use thereof UNIVERSITAT POTSDAM (DE) 2014-03-04 — — US disclosed
US-8664410-B2 Fluorescent dye and use thereof UNIVERSITAT POTSDAM (DE) 2014-03-04 — — US disclosed
EP-2399913-B1 Fluorescent dye and its application UNIV POTSDAM (DE) 2013-09-18 — — EP disclosed
US-20110319639-A1 Fluorescent Dye and Use Thereof UNIVERSITAT POTSDAM 2011-12-29 — — US disclosed
US-20110319639-A1 Fluorescent Dye and Use Thereof UNIVERSITAT POTSDAM 2011-12-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110319639-A1 Fluorescent Dye and Use Thereof AHR, ARNT, H1-0 FASN 233/4885HSD17B3 641/4885PLA2G2A 2712/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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