SCHEMBL8656107

SCHEMBL8656107

Oc1ccc(-c2ccnc3c2ccc2cccnc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.54
CCR8 P51685 4/20 0.54
CCR5 P51681 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MMP2 P08253 2/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 2/20 0.52
KDM4E B2RXH2 1/20 0.52
GMNN O75496 1/20 0.52
TP53 P04637 1/20 0.52
HSP90AA1 P07900 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
MAPT P10636 1/20 0.52
MMP9 P14780 1/20 0.52
ALOX15 P16050 1/20 0.52
NFKB1 P19838 1/20 0.52
MMP8 P22894 1/20 0.52
THPO P40225 1/20 0.52
MTOR P42345 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
SCHEMBL31403405 0.88 RPS6KA3 (0.48) CCR1CCR8CCR5TP53MAPT
SCHEMBL1701024 0.85 CCR1 (0.56) CCR1CCR8CCR5L3MBTL1MMP2
Phenanthroline SCHEMBL10705881 0.85 CCR1 (0.59) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL451290 0.85 CCR1 (0.59) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL6941422 0.85 TOP2A (0.51) COMTPIK3CDMEN1KMT2ATOP2A
SCHEMBL30287028 0.85 CCR1 (0.59) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL30964093 0.84 CCR1 (0.54) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL18388935 0.84 CCR1 (0.54) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL19318059 0.84 CCR1 (0.54) CCR1CCR8CCR5L3MBTL1MMP2
SCHEMBL22362606 0.83 CCR1 (0.57) CCR1CCR8CCR5L3MBTL1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811526-A LUMINESCENT IRIDIUM COMPLEXES, E.G. IR(BIPY)2(4'-(1,10-PHENANTHROLINE))-PHENOXYACETIC ACID)(3+),FOR IMMUNOASSAY; STABILITY; LONG LIFE; NONTOXIC ALUSUISSE HOLDINGS A.G. (CH) 1998-09-22 US disclosed
US-5585279-A IMMUNOASSAYS LONZA GROUP, AG (CH) 1996-12-17 US disclosed
EP-0255534-B1 BINDING ASSAY AND ASSAY REAGENT CELLTECH LIMITED (GB) 1992-04-08 EP disclosed
EP-0255534-A1 BINDING ASSAY AND ASSAY REAGENT. DAVIDSON ROBERT STEPHEN 1988-02-10 EP disclosed
WO-1987004523-A1 BINDING ASSAY AND ASSAY REAGENT DAVIDSON ROBERT STEPHEN 1987-07-30 WO disclosed