SCHEMBL10001033

SCHEMBL10001033

Cc1cc2ccccc2c2ncccc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 6/20 0.76
CCR8 P51685 6/20 0.76
CCR5 P51681 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
PSMD14 O00487 3/20 0.50
COPS5 Q92905 3/20 0.50
HTT P42858 2/20 0.50
HSP90AA1 P07900 2/20 0.50
SLC6A2 P23975 1/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.49
CYP2A6 P11509 2/20 0.48
CYP1A2 P05177 1/20 0.48
LMNA P02545 3/20 0.47
KDM4E B2RXH2 1/20 0.45
GMNN O75496 1/20 0.45
TP53 P04637 1/20 0.45
MMP2 P08253 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL27935601 0.89 CCR1 (0.61) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL371564 0.86 CCR1 (1.00) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL10001034 0.85 CCR1 (0.76) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL23028693 0.85 CCR1 (0.65) CCR1CCR8CCR5L3MBTL1PSMD14
Water SCHEMBL30586101 0.85 CCR1 (0.96) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL31020233 0.85 CCR1 (0.96) CCR1CCR8CCR5L3MBTL1PSMD14
Phenanthroline SCHEMBL21518505 0.83 CCR1 (0.93) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL12914324 0.80 CCR1 (0.54) CCR1CCR8CCR5L3MBTL1HTT
SCHEMBL20713577 0.80 CCR1 (0.68) CCR1CCR8CCR5L3MBTL1PSMD14
SCHEMBL17051631 0.79 CCR1 (0.62) CCR1CCR8CCR5L3MBTL1PSMD14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11696499-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-04 US disclosed
US-11678498-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-13 US disclosed
US-11678498-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-13 US disclosed
US-11563179-B2 Compound, organic optoelectronic element comprising same and display device thereof SAMSUNG SDI CO., LTD. (KR) 2023-01-24 US disclosed
US-20220209136-A1 Light-Emitting Device, Light-Emitting Apparatus, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2022-06-30 US disclosed
US-11217758-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2022-01-04 US disclosed
US-11056541-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. 2021-07-06 US disclosed
US-20200321538-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-10-08 US disclosed
US-10727418-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-28 US disclosed
US-20200144337-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2020-05-07 US disclosed
US-20160240793-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING SAME LG CHEM, LTD. (KR) 2016-08-18 US disclosed
US-20160233431-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING SAME LG CHEM, LTD. (KR) 2016-08-11 US disclosed
US-20150364694-A1 ORGANIC COMPOUND, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE CHEIL INDUSTRIES INC. (KR) 2015-12-17 US disclosed
US-9040704-B2 Fluorescent dyes with large stokes shifts UTI LIMITED PARTNERSHIP (CA) 2015-05-26 US disclosed
US-20150076470-A1 Luminescent Cyclometallated Iridium (III) Complexes Having Acetylide Ligands UNIV SOUTHERN CALIFORNIA (US) 2015-03-19 US disclosed
US-8822042-B2 Luminescent cyclometallated iridium(III) complexes having acetylide ligands THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2014-09-02 US disclosed
US-20140206870-A1 FLUORSCENT DYES WITH LARGE STOKES SHIFTS UTI LIMITED PARTNERSHIP (CA) 2014-07-24 US disclosed
US-20120007061-A1 Luminescent Cyclometallated Iridium(III) Complexes Having Acetylide Ligands THE UNIVERSITY OF SOUTHERN CALIFORNIA 2012-01-12 US disclosed
US-20070276104-A1 LIGAND-FUNCTIONALIZED/AZO COMPOUNDS AND METHODS OF USE THEREOF HARRUNA ISSIFU I 2007-11-29 US disclosed
US-20070276104-A1 LIGAND-FUNCTIONALIZED/AZO COMPOUNDS AND METHODS OF USE THEREOF HARRUNA ISSIFU I 2007-11-29 US 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 (6 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-20120007061-A1 Luminescent Cyclometallated Iridium(III) Complexes Having Acetylide Ligands ACACA, SIRT3, ICOSLG CCR1 2328/4885CCR8 2534/4885CCR5 1858/4885
US-20160240793-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING SAME CRY1, CRY2, NR2E3 CCR1 3949/4885CCR8 2152/4885CCR5 3565/4885
US-11563179-B2 Compound, organic optoelectronic element comprising same and display device thereof OR10J3, OR51E2, ORMDL3 CCR1 1340/4885CCR8 1220/4885CCR5 1799/4885
US-20070276104-A1 LIGAND-FUNCTIONALIZED/AZO COMPOUNDS AND METHODS OF USE THEREOF FLT3, ALK, NECTIN4 CCR1 204/4885CCR8 124/4885CCR5 210/4885
US-20150364694-A1 ORGANIC COMPOUND, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE OCIAD1, OR10J3, OR51E2 CCR1 256/4885CCR8 769/4885CCR5 997/4885
US-20160233431-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT USING SAME CRY1, CRY2, NR2E3 CCR1 3949/4885CCR8 2152/4885CCR5 3565/4885

“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.