SCHEMBL699036

SCHEMBL699036

Clc1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.70
CCR5 P51681 3/20 0.70
CCR8 P51685 3/20 0.70
L3MBTL1 Q9Y468 3/20 0.54
KDM4E B2RXH2 5/20 0.53
LMNA P02545 3/20 0.53
TP53 P04637 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
ALOX15 P16050 2/20 0.53
HTT P42858 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
ALPL P05186 1/20 0.53
HSP90AA1 P07900 1/20 0.53
ALPI P09923 1/20 0.53
ALPG P10696 1/20 0.53
MAPK1 P28482 1/20 0.53
METAP1 P53582 2/20 0.50
CYP1A2 P05177 1/20 0.50
POLB P06746 1/20 0.50
BLM P54132 1/20 0.50

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
SCHEMBL30063905 1.00 CCR1 (0.70) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL29260547 1.00 CCR1 (0.70) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL13311187 0.91 CCR1 (0.64) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL2007559 0.91 CCR1 (0.64) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL29660049 0.91 CCR1 (0.64) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL18489879 0.89 CCR1 (0.62) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL2542485 0.87 CCR1 (0.60) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL1258633 0.87 CCR1 (0.57) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL23711905 0.87 CCR1 (0.62) CCR1CCR5CCR8L3MBTL1KDM4E
SCHEMBL4951059 0.87 KDM4E (0.70) CCR1CCR5CCR8L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105097175-B Bifunctional molecule magnet material and its synthetic method 东华理工大学 2017-03-08 CN claimed
CN-105097175-A Double-functional molecular magnet material and synthesis method thereof EAST CHINA INST TECHNOLOGY 2015-11-25 CN claimed
CN-118206774-A Non-fully conjugated metal-supermolecular polymer and preparation method and application thereof 河南大学 2024-06-18 CN disclosed
US-11362282-B2 Heterocyclic compound and organic light emitting element comprising same LT MATERIALS CO., LTD. (KR) 2022-06-14 US disclosed
US-20210234102-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2021-07-29 US disclosed
US-10724903-B2 Polymer encapsulated particles as surface enhanced Raman scattering probes NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2020-07-28 US disclosed
US-10724903-B2 Polymer encapsulated particles as surface enhanced Raman scattering probes NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2020-07-28 US disclosed
WO-2020067595-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 희성소재(주) 2020-04-02 WO disclosed
CN-105097175-B Bifunctional molecule magnet material and its synthetic method 东华理工大学 2017-03-08 CN disclosed
US-9520611-B2 Redox flow battery SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-12-13 US disclosed
CN-105175458-A Preparation method of Co-Tb difunctional molecular magnetic material WU BIN 2015-12-23 CN disclosed
US-20120052423-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-20120052423-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
US-20120052423-A1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-03-01 US disclosed
EP-2423752-A1 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus Canon Kabushiki Kaisha (JP) 2012-02-29 EP disclosed
US-20110151586-A1 POLYMER ENCAPSULATED PARTICLES AS SURFACE ENHANCED RAMAN SCATTERING PROBES Nanyang Technological Yniversity 2011-06-23 US disclosed
US-20110151586-A1 POLYMER ENCAPSULATED PARTICLES AS SURFACE ENHANCED RAMAN SCATTERING PROBES Nanyang Technological Yniversity 2011-06-23 US disclosed
US-20110151586-A1 POLYMER ENCAPSULATED PARTICLES AS SURFACE ENHANCED RAMAN SCATTERING PROBES Nanyang Technological Yniversity 2011-06-23 US disclosed
WO-2009142604-A1 POLYMER ENCAPSULATED PARTICLES AS SURFACE ENHANCED RAMAN SCATTERING PROBES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2009-11-26 WO disclosed
EP-0677293-A1 PHARMACEUTICAL USE OF TERPYRIDINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-10-18 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 (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-20210234102-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 CCR1 2202/4885CCR5 3384/4885CCR8 3189/4885
US-11362282-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, CYP1A1 CCR1 2202/4885CCR5 3384/4885CCR8 3189/4885

“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.