SCHEMBL5146933

SCHEMBL5146933

O=c1oc2cc(O)ccc2c(-c2ccc(OCCN3CCCCC3)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 18/20 0.75
XDH P47989 2/20 0.56
ESR2 Q92731 2/20 0.56

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
SCHEMBL4641975 0.89 ESR1 (0.68) ESR1ESR2
SCHEMBL5142312 0.89 ESR1 (0.75) ESR1
SCHEMBL6810576 0.88 ESR1 (0.68) ESR1ESR2
Hydrochloric Acid SCHEMBL5417631 0.88 ESR1 (0.67) ESR1ESR2
SCHEMBL5146936 0.81 ESR1 (0.51) ESR1ESR2
SCHEMBL14506973 0.81 ESR1 (0.68) ESR1ESR2
SCHEMBL14622402 0.81 ESR1 (0.77) ESR1ESR2
SCHEMBL14428679 0.80 ESR1 (0.58) ESR1XDHESR2
SCHEMBL14428674 0.80 ESR1 (0.68) ESR1XDHESR2
SCHEMBL5167693 0.80 ESR1 (0.68) ESR1XDHESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1450812-A4 USE OF BENZOPYRANONES FOR TREATING OR PREVENTING A PRIMARY BRAIN CANCER OR A BRAIN METASTASIS SIGNAL PHARM INC (US) 2007-03-28 EP disclosed
US-7148252-B2 Use of benzopyranones for treating or preventing a primary brain cancer or a brain metastasis SIGNAL PHARMACEUTICALS, LLC (US) 2006-12-12 US disclosed
EP-1246814-B1 COMPOUNDS AND METHODS FOR MODULATION OF ESTROGEN RECEPTORS SIGNAL PHARM INC (US) 2005-02-16 EP disclosed
EP-1450812-A2 USE OF BENZOPYRANONES FOR TREATING OR PREVENTING A PRIMARY BRAIN CANCER OR A BRAIN METASTASIS Signal Pharmaceuticals, Inc. (US) 2004-09-01 EP disclosed
US-20030149025-A1 Use of benzopyranones for treating or preventing a primary brain cancer or a brain metastasis SIGNAL PHARMACEUTICALS, INC. 2003-08-07 US disclosed
WO-2003028652-A2 USE OF BENZOPYRANONES FOR TREATING OR PREVENTING A PRIMARY BRAIN CANCER OR A BRAIN METASTASIS SIGNAL PHARMACEUTICALS, INC. (US) 2003-04-10 WO disclosed
US-6331562-B1 SELECTIVELY MODULATE ESTROGEN RECEPTOR-BETA ACTIVITY; INHIBIT CYTOKINES SUCH AS INTERLEUKIN-6 SIGNAL PHARMACEUTICALS, INC. 2001-12-18 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-20030149025-A1 Use of benzopyranones for treating or preventing a primary brain cancer or a brain metastasis RB1, FOXK1, SKP1 ESR1 2470/4885XDH 661/4885ESR2 1390/4885

“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.