SCHEMBL842949

SCHEMBL842949

Cc1ccnc(-c2ccncc2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.67
CCR5 P51681 1/20 0.67
CCR8 P51685 1/20 0.67
CYP2A6 P11509 1/20 0.61
UHRF1 Q96T88 1/20 0.48
METAP2 P50579 1/20 0.47
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NOS3 P29474 1/20 0.45
NOS1 P29475 1/20 0.45
NOS2 P35228 1/20 0.45
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
RECQL P46063 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HTT P42858 2/20 0.43
FLT3 P36888 1/20 0.43
DYRK1A Q13627 1/20 0.43

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
SCHEMBL19020245 0.90 CCR1 (0.59) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL27344644 0.89 CCR1 (0.76) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL31695263 0.89 CCR1 (0.76) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL6807225 0.84 CCR1 (0.70) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL29463685 0.84 CCR1 (0.70) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL19009240 0.84 CYP2A6 (0.58) CCR1CCR5CCR8CYP2A6KDM4E
SCHEMBL29446990 0.83 CYP2A6 (0.67) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL842170 0.83 CYP2A6 (0.67) CCR1CCR5CCR8CYP2A6UHRF1
SCHEMBL12339160 0.82 NPC1 (0.50) CCR1CCR5CCR8CYP2A6KDM4E
SCHEMBL12339139 0.82 NPC1 (0.50) CCR1CCR5CCR8CYP2A6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11818932-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-11706973-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-18 US disclosed
US-11696496-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-11653563-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-16 US disclosed
US-20230096132-A1 CYCLOALKANE-FUSED POLYCYCLIC AROMATIC COMPOUND KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2023-03-30 US disclosed
US-11617290-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2023-03-28 US disclosed
US-11329230-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2022-05-10 US disclosed
US-11316117-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2022-04-26 US disclosed
US-20210336144-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-10-28 US disclosed
US-20110112077-A1 Quinolizidinone m1 Receptor Positive Allosteric Modulators MERCK SHARP & DOHME CORP. (US) 2011-05-12 US disclosed
US-20100249406-A1 PHENYL-SUBSTITUTED 1,3.5-TRIAZINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING THE SAME AS COMPONENT TOSOH CORPORATION (JP) 2010-09-30 US disclosed
US-20100249406-A1 PHENYL-SUBSTITUTED 1,3.5-TRIAZINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING THE SAME AS COMPONENT TOSOH CORPORATION (JP) 2010-09-30 US disclosed
US-20100204235-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-08-12 US disclosed
US-20100204235-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-08-12 US disclosed
US-20100041662-A1 Heterocyclic compounds as antiinflammatory agents FERRAND SANDRINE 2010-02-18 US disclosed
US-20100041662-A1 Heterocyclic compounds as antiinflammatory agents FERRAND SANDRINE 2010-02-18 US disclosed
WO-2009013335-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-01-29 WO disclosed
WO-2008052734-A1 HETEROCYCLIC COMPOUNDS AS ANTIINFLAMMATORY AGENTS NOVARTIS AG (CH) 2008-05-08 WO disclosed
WO-2002076983-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-10-03 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 (8 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-20230096132-A1 CYCLOALKANE-FUSED POLYCYCLIC AROMATIC COMPOUND LAGE3, ELOC, ELOB CCR1 275/4885CCR5 1093/4885CCR8 53/4885
US-11329230-B2 Organic light-emitting device EML4, SUN2, TRPA1 CCR1 2925/4885CCR5 2650/4885CCR8 2616/4885
US-11706973-B2 Condensed cyclic compound and organic light-emitting device including the same C1S, CCNT1, C9 CCR1 72/4885CCR5 894/4885CCR8 874/4885
US-20100204235-A1 ORGANIC COMPOUNDS ALK, OR10J3, FFAR4 CCR1 368/4885CCR5 247/4885CCR8 523/4885
US-20100249406-A1 PHENYL-SUBSTITUTED 1,3.5-TRIAZINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE CONTAINING THE SAME AS COMPONENT H1-5, H1-4, H1-2 CCR1 2985/4885CCR5 3911/4885CCR8 4529/4885
US-11316117-B2 Organometallic compound and organic light-emitting device including the same OCIAD1, L3MBTL1, OCIAD2 CCR1 1787/4885CCR5 2620/4885CCR8 4025/4885
US-20100041662-A1 Heterocyclic compounds as antiinflammatory agents JAK2, IRAK4, ALK CCR1 223/4885CCR5 191/4885CCR8 321/4885
US-20110112077-A1 Quinolizidinone m1 Receptor Positive Allosteric Modulators CHRM1, CHRM2, OPRL1 CCR1 3490/4885CCR5 1469/4885CCR8 4805/4885

“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.