SCHEMBL14901485

SCHEMBL14901485

COCC(O)COc1ccc(Oc2ccc(OCC(O)COC(C)C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ADRB2 P07550 2/20 0.46
ADRB1 P08588 2/20 0.46
NR3C1 P04150 1/20 0.46
CYP2D6 P10635 1/20 0.46
ADRA1A P35348 1/20 0.46
CYP2J2 P51589 1/20 0.46
PDE4D Q08499 1/20 0.46
NR2E1 Q9Y466 1/20 0.46
ADRB3 P13945 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
ALDH1A1 P00352 1/20 0.41
ACACB O00763 1/20 0.41

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
SCHEMBL14901488 0.90 ALDH1A1 (0.48) POLBMAPTLMNANPSR1ADRB2
SCHEMBL14901479 0.90 POLB (0.55) POLBMAPTLMNANPSR1ADRB2
SCHEMBL14901486 0.86 ADRB2 (0.43) POLBMAPTLMNANPSR1ADRB2
SCHEMBL14901504 0.86 AR (0.51) POLBMAPTLMNANPSR1ADRB2
SCHEMBL14901483 0.85 POLB (0.56) POLBMAPTLMNANPSR1SMN1; SMN2
SCHEMBL12267326 0.85 HTT (0.59) POLBMAPTLMNANPSR1ADRB2
SCHEMBL29620619 0.83 LMNA (0.55) POLBMAPTLMNANPSR1ADRB2
SCHEMBL14901482 0.79 POLB (0.55) POLBMAPTLMNANPSR1ADRB2
SCHEMBL12267197 0.79 HTT (0.56) POLBMAPTLMNANPSR1ADRB2
SCHEMBL13191254 0.78 SMN1; SMN2 (0.41) MAPTNR2E1MEN1KMT2ASMN1; SMN2

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-20130109758-A1 BISPHENOL DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-05-02 US disclosed
US-20130109758-A1 BISPHENOL DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2013-05-02 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-20130109758-A1 BISPHENOL DERIVATIVE THERAPEUTICS AND METHODS FOR THEIR USE SHBG, KLK3, HSD17B11 POLB 388/4885MAPT 1962/4885LMNA 1050/4885

“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.