SCHEMBL113833

SCHEMBL113833

COc1ccc2c(c1)CCC(Br)=C2c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.73

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.73
SIGMAR1 Q99720 1/20 0.73
HRH3 Q9Y5N1 5/20 0.55
ESR1 P03372 5/20 0.54
ESR2 Q92731 3/20 0.54
LTA4H P09960 3/20 0.50
MAOB P27338 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
SCHEMBL5713216 0.88 EBP (0.57) EBPSIGMAR1HRH3ESR1ESR2
SCHEMBL3781069 0.88 EBP (0.58) EBPSIGMAR1HRH3ESR1ESR2
SCHEMBL7213535 0.87 EBP (0.76) EBPSIGMAR1HRH3ESR1ESR2
SCHEMBL8015672 0.86 EBP (0.88) EBPSIGMAR1HRH3ESR1ESR2
Nafoxidine SCHEMBL153125 0.84 EBP (1.00) EBPSIGMAR1HRH3ESR1ESR2
Nafoxidine SCHEMBL10563464 0.84 EBP (1.00) EBPSIGMAR1HRH3ESR1ESR2
Nafoxidine SCHEMBL29494604 0.84 EBP (1.00) EBPSIGMAR1HRH3ESR1ESR2
SCHEMBL2180695 0.84 EBP (0.60) EBPSIGMAR1HRH3ESR1ESR2
Nafoxidine SCHEMBL115778 0.83 EBP (0.98) EBPSIGMAR1HRH3ESR1ESR2
Nafoxidine SCHEMBL29562423 0.83 EBP (0.98) EBPSIGMAR1HRH3ESR1ESR2

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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1411049-A1 Estrogen Agonists/Antagonists PFIZER INC. (US) 2004-04-21 EP claimed
US-6657058-B1 Treatment with organometallic compound capable of acting as an outer sphere oxidant PHARMACYCLICS, INC. 2003-12-02 US claimed
US-6441193-B1 INTERMEDIATES SUCH AS 1-(2-(4-(6-METHOXY-3,4-DIHYDRONAPHTHA-LEN-1-YL)PHENOXY)ETHYL)PYRROLIDINE AND COMPOUNDS SUCH AS CIS-6-PHENYL-5-(4-(2-PYRROLIDIN-1-YLETHOXY)PHENYL)-5,6,7,8 -TETRAHYDRONAPHTHALEN-2-OL, HYDROBROMIDE SALT PFIZER INC. 2002-08-27 US claimed
EP-0802910-B1 ESTROGEN AGONISTS/ANTAGONISTS PFIZER (US) 2002-03-13 EP claimed
EP-1151998-A1 Estrogen agonists/antagonists PFIZER INC. (US) 2001-11-07 EP claimed
EP-0802910-A1 ESTROGEN AGONISTS/ANTAGONISTS PFIZER INC. (US) 1997-10-29 EP claimed
WO-1996021656-A1 ESTROGEN AGONISTS/ANTAGONISTS PFIZER, INC. (US) 1996-07-18 WO claimed
US-8937188-B2 Process for the preparation of lasofoxifene tartrate GLENMARK GENERICS LTD. (IN) 2015-01-20 US disclosed
WO-2012159981-A2 PROCESS FOR THE PREPARATION OF α-SUBSTITUTED KETONES AND THEIR APPLICATION IN SYNTHESIS OF PHARMACEUTICALLY ACTIVE COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2012-11-29 WO disclosed
EP-1534248-B1 LASOFOXIFENE TABLET AND ITS COATING PFIZER PROD INC (US) 2012-03-21 EP disclosed
EP-2424839-A2 A PROCESS FOR THE PREPARATION OF LASOFOXIFENE TARTRATE Glenmark Generics Limited (IN) 2012-03-07 EP disclosed
US-20120045648-A1 PROCESS FOR THE PREPARATION OF LASOFOXIFENE TARTRATE GLENMARK GENERRICS LTD (IN) 2012-02-23 US disclosed
US-20100317712-A1 Estrogen Agonists/Antagonists For Preventing Breast Cancer CAMERON KIMBERLY O 2010-12-16 US disclosed
US-6153622-A Estrogen agonists/antagonists PFIZER, INC. (US) 2000-11-28 US disclosed
EP-1004306-A2 Estrogen agonists/antagonists Pfizer Products Inc. (US) 2000-05-31 EP disclosed
EP-0876359-A1 (-) CIS-6(S)-PHENYL-5(R) 4-(2-PYRROLIDIN-1-YLETHOXY)PHENYL]-5,6,7,8-TETRAHYDRONAPHTHALEN-2-OL D-TARTRATE PFIZER INC. (US) 1998-11-11 EP disclosed
EP-0802910-A1 ESTROGEN AGONISTS/ANTAGONISTS PFIZER INC. (US) 1997-10-29 EP disclosed
WO-1997016434-A1 (-) CIS-6(S)-PHENYL-5(R)[4-(2-PYRROLIDIN-1-YLETHOXY)PHENYL]-5,6,7,8-TETRAHYDRONAPHTHALEN-2-OL D-TARTRATE PFIZER INC. (US) 1997-05-09 WO disclosed
US-5552412-A 5-substitued-6-cyclic-5,6,7,8-tetrahydronaphthalen2-ol compounds which are useful for treating osteoporosis PFIZER INC (US) 1996-09-03 US disclosed
WO-1996021656-A1 ESTROGEN AGONISTS/ANTAGONISTS PFIZER, INC. (US) 1996-07-18 WO 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 (2 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-20120045648-A1 PROCESS FOR THE PREPARATION OF LASOFOXIFENE TARTRATE CYP19A1, CYP51A1, CYP2F1 EBP 1181/4885SIGMAR1 1272/4885HRH3 3800/4885
US-20100317712-A1 Estrogen Agonists/Antagonists For Preventing Breast Cancer ESR1, GPER1, ESR2 EBP 42/4885SIGMAR1 606/4885HRH3 2730/4885

“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.