SCHEMBL2131185

SCHEMBL2131185

C=CCN(C)CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LSS P48449 20/20 1.00
MEN1 O00255 1/20 0.76
KMT2A Q03164 1/20 0.76

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
SCHEMBL3811386 1.00 LSS (1.00) LSSMEN1KMT2A
Bromide SCHEMBL8048776 0.99 LSS (0.98) LSSMEN1KMT2A
SCHEMBL3671762 0.99 LSS (0.98) LSSMEN1KMT2A
Bromide SCHEMBL8047816 0.98 LSS (0.95) LSSMEN1KMT2A
SCHEMBL9364394 0.89 LSS (1.00) LSSMEN1KMT2A
SCHEMBL7681351 0.88 LSS (0.78) LSSMEN1KMT2A
SCHEMBL9360507 0.88 LSS (1.00) LSSMEN1KMT2A
SCHEMBL3816721 0.88 LSS (0.80) LSSMEN1KMT2A
SCHEMBL3363133 0.88 LSS (0.78) LSSMEN1KMT2A
SCHEMBL7679409 0.87 LSS (1.00) LSSMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 EP claimed
US-5574071-A ADMINISTERING PHENYLALKYLAMINO KETONES HOFFMANN-LA ROCHE INC. (US) 1996-11-12 US claimed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 EP claimed
EP-2866810-B9 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER UNIV MISSOURI (US) 2019-06-26 EP disclosed
EP-2446276-B9 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM INST NAT DE LA SANTÉ ET DE LA RECH MÉDICALE (FR) 2016-05-04 EP disclosed
US-20150366824-A1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER THE CURATORS OF THE UNIVERSITY OF MISSOURI 2015-12-24 US disclosed
US-20150366824-A1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER THE CURATORS OF THE UNIVERSITY OF MISSOURI 2015-12-24 US disclosed
EP-2446276-B1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM INST NAT DE LA SANTÉ ET DE LA RECH MÉDICALE (FR) 2014-08-20 EP disclosed
US-20140221353-A1 Methods for Determining the Oncogenic Condition of Cell, Uses Thereof, and Methods for Treating Cancer AFFICHEM (FR) 2014-08-07 US disclosed
EP-2446276-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2012-05-02 EP disclosed
US-20120100124-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2012-04-26 US disclosed
WO-2010149941-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2010-12-29 WO disclosed
US-20100092479-A1 Compositions and methods for treatment of viral diseases COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-04-15 US disclosed
WO-2010021681-A2 COMPOSITIONS AND METHODS FOR TREATMENT OF VIRAL DISEASES COMBINATORX (SINGAPORE) PTE. LTD. (SG) 2010-02-25 WO disclosed
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 EP disclosed
US-5637771-A Compound useful for lowering cholesterol HOFFMANN-LA ROCHE INC. (US) 1997-06-10 US disclosed
US-5574071-A ADMINISTERING PHENYLALKYLAMINO KETONES HOFFMANN-LA ROCHE INC. (US) 1996-11-12 US disclosed
US-5495048-A ANTICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 US disclosed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 EP 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 (3 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-20150366824-A1 INDUCTION OF ESTROGEN RECEPTOR BETA BY CHOLESTEROL BIOSYNTHESIS INHIBITORS AND METHODS OF TREATMENT OF CANCER ESRRA, ESRRB, ESRRG LSS 276/4885MEN1 4535/4885KMT2A 3444/4885
US-20100092479-A1 Compositions and methods for treatment of viral diseases HAVCR2, RNASE1, EIF2AK2 LSS 2247/4885MEN1 4176/4885KMT2A 1512/4885
US-20120100124-A1 METHODS FOR DETERMINING THE ONCOGENIC CONDITION OF CELL, USES THEREOF, AND METHODS FOR TREATING CANCER MYC, CCNO, MKI67 LSS 3941/4885MEN1 2343/4885KMT2A 437/4885

“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.