SCHEMBL11525680

SCHEMBL11525680

CC(=O)OCCOC(=O)c1ccccc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.71
TSHR P16473 6/20 0.58
LMNA P02545 3/20 0.56
ALDH1A1 P00352 3/20 0.55
L3MBTL1 Q9Y468 3/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 1/20 0.53
SERPINE1 P05121 1/20 0.51
TP53 P04637 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48

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
SCHEMBL26603177 0.93 TDP1 (0.77) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL31185589 0.93 TDP1 (0.77) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL27542464 0.93 TDP1 (0.83) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL6063013 0.91 TDP1 (0.85) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL30416074 0.91 TDP1 (0.85) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL12956520 0.89 TDP1 (0.61) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL15852963 0.89 TSHR (0.71) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL11530630 0.86 TSHR (0.79) TDP1TSHRLMNAALDH1A1L3MBTL1
Ethylene Glycol SCHEMBL432445 0.85 TDP1 (0.76) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL6062602 0.85 TDP1 (0.76) TDP1TSHRLMNAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230338543-A1 GAMMA-HYDROXYBUTYRATE DELIVERING COMPOUNDS AND PROCESSES FOR MAKING AND USING THEM ALTER DOMUS (US) LLC 2023-10-26 US disclosed
US-4145342-A NITRO-DIPHENYLAMINO-AZO-PHENYL DYESTUFFS CONTAINING A POLYALKYENEOXY GROUP BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 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-20230338543-A1 GAMMA-HYDROXYBUTYRATE DELIVERING COMPOUNDS AND PROCESSES FOR MAKING AND USING THEM HSD17B10, HSD17B12, HSD17B14 TDP1 1703/4885TSHR 2666/4885LMNA 2652/4885

“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.