SCHEMBL2453227

SCHEMBL2453227

C1=Cc2ccc3cccnc3c2C=[N+]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 4/20 0.48
▸ CCR8 P51685 4/20 0.48
▸ LMNA P02545 3/20 0.48
▸ CCR5 P51681 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ MMP2 P08253 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ GMNN O75496 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MMP9 P14780 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ MMP8 P22894 1/20 0.48
▸ THPO P40225 1/20 0.48
▸ MTOR P42345 1/20 0.48
▸ HTT P42858 1/20 0.48

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
SCHEMBL2472441 0.87 CCR1 (0.48) CCR1CCR8LMNACCR5KDM4E
SCHEMBL3201545 0.74 LMNA (0.54) CCR1CCR8LMNACCR5KDM4E
SCHEMBL2470104 0.73 MAPT (0.48) LMNAKDM4ETSHRMAPTHSP90AA1
Phenanthroline SCHEMBL29013283 0.69 CCR1 (0.89) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL29367277 0.69 CCR1 (1.00) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL29354015 0.69 CCR1 (1.00) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL8845760 0.69 CCR1 (1.00) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL8312 0.69 CCR1 (1.00) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL22982126 0.66 CCR1 (0.94) CCR1CCR8LMNACCR5KDM4E
Phenanthroline SCHEMBL21044608 0.66 CCR1 (0.94) CCR1CCR8LMNACCR5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1643812-B1 ORGANIC ELECTROLUMINESCENT DEVICE AND DISPLAY USING SAME IDEMITSU KOSAN CO (JP) 2011-09-21 — — EP disclosed
US-6821644-B2 BIS(DIARYLAMINO)ARYLENE COMPOUND; BRILLIANCE, DURABILITY SAMSUNG SDI CO., LTD. (KR) 2004-11-23 — — US disclosed
US-20010012571-A1 Organic electroluminescent device SAMSUNG DISPLAY CO., LTD. (KR) 2001-08-09 — — US disclosed
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