SCHEMBL30286995

SCHEMBL30286995

Cc1cc2ccc3cccnc3c2nc1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 5/20 0.62
CCR8 P51685 5/20 0.62
CCR5 P51681 3/20 0.61
LMNA P02545 4/20 0.59
KDM4E B2RXH2 3/20 0.59
MAPT P10636 3/20 0.59
HTT P42858 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
MMP2 P08253 2/20 0.59
TSHR P16473 2/20 0.59
GMNN O75496 1/20 0.59
TP53 P04637 1/20 0.59
HSP90AA1 P07900 1/20 0.59
CYP3A4 P08684 1/20 0.59
CYP2D6 P10635 1/20 0.59
MMP9 P14780 1/20 0.59
ALOX15 P16050 1/20 0.59
NFKB1 P19838 1/20 0.59
MMP8 P22894 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
SCHEMBL529761 1.00 CCR1 (0.62) CCR1CCR8CCR5LMNAKDM4E
Water SCHEMBL27996227 0.98 CCR1 (0.61) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL20263747 0.87 TDP2 (0.53) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL27788693 0.82 CCR1 (0.59) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL15460375 0.82 CCR1 (0.43) CCR1CCR8CCR5LMNAKDM4E
Phenanthroline SCHEMBL21518505 0.81 CCR1 (0.93) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL12900916 0.80 CCR1 (0.76) CCR1CCR8CCR5LMNAKDM4E
Phenanthroline SCHEMBL3812011 0.79 CCR1 (0.94) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL1133753 0.77 CCR1 (0.57) CCR1CCR8CCR5LMNAKDM4E
SCHEMBL873855 0.77 LMNA (0.56) CCR1CCR8CCR5LMNAKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118772133-A Light-emitting element and amine compound for use in the same 三星显示有限公司 2024-10-15 CN disclosed
CN-118630243-A Perfluorinated ion polymer with phenanthroline side group, synthesis method thereof and proton exchange membrane and membrane electrode for fuel cell 山东东岳未来氢能材料股份有限公司 2024-09-10 CN disclosed
CN-115881996-B Perfluorinated ion polymer with phenanthroline side group, synthesis method thereof and proton exchange membrane and membrane electrode for fuel cell 山东东岳未来氢能材料股份有限公司 2024-06-11 CN disclosed
CN-115881996-A Perfluoro ionic polymer with phenanthroline side group, synthetic method thereof, proton exchange membrane and membrane electrode for fuel cell 山东东岳未来氢能材料股份有限公司 2023-03-31 CN disclosed