SCHEMBL14901537

SCHEMBL14901537

CC(=O)OCCOc1ccc(Oc2ccc(OCCCCl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
LTA4H P09960 6/20 0.46
GAA P10253 1/20 0.46
PPARA Q07869 1/20 0.44
MAPT P10636 3/20 0.42
PPARG P37231 1/20 0.42
ALDH1A1 P00352 3/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
P2RY12 Q9H244 1/20 0.41
HPGD P15428 1/20 0.40
RAB9A P51151 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
SCHEMBL14901539 0.90 L3MBTL1 (0.47) L3MBTL1GAAMAPTALDH1A1PDE3B
SCHEMBL14901534 0.87 L3MBTL1 (0.53) L3MBTL1GAAPPARAMAPTPPARG
SCHEMBL14901538 0.86 L3MBTL1 (0.44) L3MBTL1GAAMAPTALDH1A1PDE3B
SCHEMBL10030181 0.86 L3MBTL1 (0.55) L3MBTL1GAAMAPTALDH1A1PDE3B
SCHEMBL27495385 0.85 ALDH1A1 (0.47) L3MBTL1GAAMAPTALDH1A1RAB9A
SCHEMBL12516025 0.84 AR (0.54) L3MBTL1GAAMAPTALDH1A1
SCHEMBL28492938 0.81 CYP1A2 (0.54) L3MBTL1MAPTALDH1A1
SCHEMBL9118684 0.80 L3MBTL1 (0.50) L3MBTL1GAAMAPTALDH1A1PDE3B
SCHEMBL10030195 0.80 L3MBTL1 (0.59) L3MBTL1GAAMAPTALDH1A1PDE3B
SCHEMBL12517382 0.80 LTA4H (0.56) LTA4HPPARA

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 L3MBTL1 2335/4885LTA4H 2660/4885GAA 2231/4885

“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.