SCHEMBL14901508

SCHEMBL14901508

O=C(c1ccc(OCC(O)CO)cc1)c1ccc(OCC(O)CO)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.61
MAPT P10636 2/20 0.61
POLB P06746 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
ABCB1 P08183 5/20 0.56
MAPK1 P28482 3/20 0.55
ALDH1A1 P00352 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
AR P10275 1/20 0.50
GAA P10253 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HTT P42858 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
SCHEMBL2384639 0.93 ABCB1 (0.66) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL11554662 0.92 LMNA (0.61) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL14901496 0.92 AR (0.62) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL16387655 0.92 AR (0.62) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL16387650 0.92 AR (0.62) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL16387651 0.92 AR (0.62) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL16387652 0.92 AR (0.62) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL12516207 0.88 LMNA (0.49) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL24198673 0.87 PLA2G4B (0.61) LMNAMAPTPOLBNPSR1ABCB1
SCHEMBL17908021 0.87 PLA2G4B (0.61) LMNAMAPTPOLBNPSR1ABCB1

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 LMNA 1050/4885MAPT 1962/4885POLB 388/4885

“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.