SCHEMBL1993385

SCHEMBL1993385

Clc1ccnc(-c2cccc(-c3ccccn3)n2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.72
CCR5 P51681 3/20 0.72
CCR8 P51685 3/20 0.72
KDM4E B2RXH2 7/20 0.67
TP53 P04637 4/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
LMNA P02545 3/20 0.67
L3MBTL1 Q9Y468 3/20 0.67
ALOX15 P16050 2/20 0.67
HTT P42858 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
ALPL P05186 1/20 0.67
HSP90AA1 P07900 1/20 0.67
ALPI P09923 1/20 0.67
ALPG P10696 1/20 0.67
MAPK1 P28482 1/20 0.67
METAP1 P53582 2/20 0.52
CYP1A2 P05177 1/20 0.52
POLB P06746 1/20 0.52
BLM P54132 1/20 0.52

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
SCHEMBL913279 0.92 CCR1 (0.70) CCR1CCR5CCR8KDM4ETP53
SCHEMBL29577140 0.92 CCR1 (0.70) CCR1CCR5CCR8KDM4ETP53
SCHEMBL8526623 0.92 CCR1 (0.62) CCR1CCR5CCR8KDM4ETP53
2-Mercaptopyrimidine SCHEMBL7794551 0.91 CCR1 (0.60) CCR1CCR5CCR8KDM4ETP53
4-Mercaptopyridine SCHEMBL7790757 0.87 CCR1 (0.55) CCR1CCR5CCR8KDM4ETP53
SCHEMBL517337 0.84 CCR1 (1.00) CCR1CCR5CCR8KDM4ETP53
SCHEMBL1617719 0.82 CCR1 (0.96) CCR1CCR5CCR8KDM4ETP53
SCHEMBL7964803 0.82 KDM4E (1.00) CCR1CCR5CCR8KDM4ETP53
Terpyridine SCHEMBL29357603 0.82 KDM4E (1.00) CCR1CCR5CCR8KDM4ETP53
Terpyridine SCHEMBL57442 0.82 KDM4E (1.00) CCR1CCR5CCR8KDM4ETP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024081853-A2 MONOAMINE OXIDASE (MAO) ELECTROCHEMICAL BIOSENSOR AND USES THEREOF TRUSTEES OF BOSTON UNIVERSITY (US) 2024-04-18 WO disclosed
US-10724903-B2 Polymer encapsulated particles as surface enhanced Raman scattering probes NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2020-07-28 US disclosed
EP-3240833-B1 LUMINESCENT SILICONE COATINGS MOMENTIVE PERFORMANCE MAT INC (US) 2020-06-03 EP disclosed
US-10294332-B2 Functionalized siloxane materials MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2019-05-21 US disclosed
US-20180016401-A1 FUNCTIONALIZED SILOXANE MATERIALS MOMENTIVE PERFORMANCE MATERIALS INC. 2018-01-18 US disclosed
US-20170369715-A1 LUMINESCENT SILICONE COATINGS MOMENTIVE PERFORMANCE MATERIALS INC. 2017-12-28 US disclosed
EP-3240807-A1 FUNCTIONALIZED SILOXANE MATERIALS Momentive Performance Materials Inc. (US) 2017-11-08 EP disclosed
EP-3240833-A1 LUMINESCENT SILICONE COATINGS Momentive Performance Materials Inc. (US) 2017-11-08 EP disclosed
WO-2016144016-A1 METHOD FOR PREPARING BIOSUGAR AND QUERCETIN BY USING ONION SKINS 전남대학교산학협력단 2016-09-15 WO disclosed
WO-2016109537-A1 FUNCTIONALIZED SILOXANE MATERIALS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-07-07 WO disclosed
US-20090106915-A1 Coloring keratin fibers with metal complexes CIBA SPECIALTY CHEMICALS CORP. 2009-04-30 US disclosed
EP-1879548-A2 PROCESS FOR COLORING KERATIN FIBERS COMPRISING METAL COMPLEXES Ciba Specialty Chemicals Holding Inc. (CH) 2008-01-23 EP disclosed
WO-2006120133-A2 PROCESS FOR COLORING KERATIN FIBERS COMPRISING METAL COMPLEXES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-11-16 WO disclosed
US-20060019853-A1 Use of metal complex compounds as catalysts for oxidation using molecular oxygen or air CIBA SPECIALTY CHEMICALS CORP. 2006-01-26 US disclosed
EP-1556468-A1 USE OF METAL COMPLEX COMPOUNDS AS CATALYSTS FOR OXIDATION USING MOLECULAR OXYGEN OR AIR Ciba SC Holding AG (CH) 2005-07-27 EP disclosed
WO-2004039933-A1 USE OF METAL COMPLEX COMPOUNDS AS CATALYSTS FOR OXIDATION USING MOLECULAR OXYGEN OR AIR CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-05-13 WO disclosed
EP-1144423-A1 BIS-TERPYRIDINE-PLATINUM(II) COMPLEXES ISIS INNOVATION LIMITED (GB) 2001-10-17 EP disclosed
WO-2000043405-A1 BIS-TERPYRIDINE-PLATINUM(II) COMPLEXES ISIS INNOVATION LIMITED (GB) 2000-07-27 WO disclosed
EP-0885233-A1 TERPYRIDINE-PLATINUM(II) COMPLEXES ISIS INNOVATION LIMITED (GB) 1998-12-23 EP disclosed
WO-1997027202-A1 TERPYRIDINE-PLATINUM(II) COMPLEXES ISIS INNOVATION LIMITED (GB) 1997-07-31 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-20090106915-A1 Coloring keratin fibers with metal complexes KRT18, KIF5B, KIF5C CCR1 2638/4885CCR5 2154/4885CCR8 2866/4885
US-20060019853-A1 Use of metal complex compounds as catalysts for oxidation using molecular oxygen or air COX14, MICOS13, OR10J3 CCR1 1334/4885CCR5 858/4885CCR8 883/4885

“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.