SCHEMBL4281217

SCHEMBL4281217

Clc1ccc(-c2csc(-c3ccccc3)n2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.75
KDM4E B2RXH2 6/20 0.75
SMN1; SMN2 Q16637 5/20 0.75
LMNA P02545 2/20 0.75
SREBF2 Q12772 1/20 0.70
KMT2A Q03164 4/20 0.69
NPC1 O15118 4/20 0.69
CYP19A1 P11511 3/20 0.69
MEN1 O00255 3/20 0.69
AR P10275 1/20 0.69
CYP1A2 P05177 2/20 0.62
CYP1A1 P04798 1/20 0.62
CYP1B1 Q16678 1/20 0.62
ALDH1A1 P00352 3/20 0.59
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
POLB P06746 1/20 0.59
GAA P10253 1/20 0.59
PKM P14618 1/20 0.59
ALOX12 P18054 1/20 0.59

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
SCHEMBL11455457 1.00 RAB9A (0.75) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL11466217 0.93 KDM4E (0.86) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL11213828 0.91 SREBF2 (0.82) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL11215130 0.91 SREBF2 (0.82) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL11212983 0.91 SREBF2 (0.82) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL19196716 0.89 CYP19A1 (0.61) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL11464717 0.89 SREBF2 (0.79) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL2781370 0.89 KDM4E (0.85) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL4283884 0.86 KDM4E (1.00) RAB9AKDM4ESMN1; SMN2LMNASREBF2
SCHEMBL5647626 0.84 KDM4E (0.73) RAB9AKDM4ESMN1; SMN2LMNASREBF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140303213-A1 Compositions and Methods for the Treatment of Metabolic Disorders BAYLOR COLLEGE OF MEDICINE 2014-10-09 US claimed
CN-101674730-A The composition and the method that are used for the treatment of metabolic disease BAYLOR COLLEGE MEDICINE 2010-03-17 CN claimed
EP-2120580-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS Baylor College Of Medicine (US) 2009-11-25 EP claimed
US-20090131475-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS BAYLOR COLLEGE OF MEDICINE (US) 2009-05-21 US claimed
WO-2008097835-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS BAYLOR COLLEGE OF MEDICINE (US) 2008-08-14 WO claimed
WO-1998025918-A1 ANALGESIC, ANTI-INFLAMMATORY AND ANTI-THROMBOSIS ESTERS OF NITRATED CYCLOALIPHATIC ALCOHOLS HOECHST MARION ROUSSEL (FR) 1998-06-18 WO claimed
CN-110627739-B Method for synthesizing thiazole heterocyclic compound through photocatalysis 桂林医学院 2023-02-07 CN disclosed
CN-111909110-A Preparation method of 2, 4-disubstituted thiazole compound 浙江工业大学 2020-11-10 CN disclosed
CN-110627739-A Method for synthesizing thiazole heterocyclic compound through photocatalysis 桂林医学院 2019-12-31 CN disclosed
US-20180291013-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC AND RELATED DISORDERS BAYLOR COLLEGE OF MEDICINE 2018-10-11 US disclosed
US-20180071289-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER AND RELATED HYPERPROLIFERATIVE DISORDERS UESUGI MOTONARI (JP) 2018-03-15 US disclosed
EP-2120580-B1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS BAYLOR COLLEGE MEDICINE (US) 2017-12-27 EP disclosed
US-9713613-B2 Methods and compositions for the treatment of cancer and related hyperproliferative disorders BAYLOR COLLEGE OF MEDICINE 2017-07-25 US disclosed
US-8207196-B2 Compositions and methods for the treatment of metabolic disorders BAYLOR COLLEGE OF MEDICINE (US) 2012-06-26 US disclosed
CN-101674730-A The composition and the method that are used for the treatment of metabolic disease BAYLOR COLLEGE MEDICINE 2010-03-17 CN disclosed
EP-2120580-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS Baylor College Of Medicine (US) 2009-11-25 EP disclosed
US-20090131475-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS BAYLOR COLLEGE OF MEDICINE (US) 2009-05-21 US disclosed
WO-2008097835-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS BAYLOR COLLEGE OF MEDICINE (US) 2008-08-14 WO disclosed
WO-2007062222-A2 INHIBITION OF CELL PROLIFERATION UNIVERSITY OF SOUTH FLORIDA (US) 2007-05-31 WO disclosed
WO-1998025918-A1 ANALGESIC, ANTI-INFLAMMATORY AND ANTI-THROMBOSIS ESTERS OF NITRATED CYCLOALIPHATIC ALCOHOLS HOECHST MARION ROUSSEL (FR) 1998-06-18 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 (4 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-20180071289-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER AND RELATED HYPERPROLIFERATIVE DISORDERS HCCS, PCNA, MKI67 RAB9A 3982/4885KDM4E 2557/4885SMN1; SMN2 2848/4885
US-20180291013-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC AND RELATED DISORDERS FABP4, LIPC, PNLIP RAB9A 3100/4885KDM4E 2808/4885SMN1; SMN2 3787/4885
US-20140303213-A1 Compositions and Methods for the Treatment of Metabolic Disorders FABP4, LIPC, PNLIP RAB9A 3332/4885KDM4E 2584/4885SMN1; SMN2 3753/4885
US-20090131475-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF METABOLIC DISORDERS FABP4, LIPC, FABP1 RAB9A 3385/4885KDM4E 2849/4885SMN1; SMN2 3732/4885

“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.