SCHEMBL5115970

SCHEMBL5115970

c1ccc(N(c2cccc(-c3ccccn3)c2)c2cccc(-c3ccccn3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.46
LMNA P02545 4/20 0.45
KDM4E B2RXH2 4/20 0.45
CCR1 P32246 2/20 0.45
CCR5 P51681 2/20 0.45
CCR8 P51685 2/20 0.45
CYP1A2 P05177 1/20 0.45
POLB P06746 1/20 0.45
METAP1 P53582 1/20 0.45
BLM P54132 1/20 0.45
HIF1A Q16665 1/20 0.45
DOHH Q9BU89 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
HTR1A P08908 1/20 0.44
HTR7 P34969 1/20 0.44
TP53 P04637 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
ALOX15 P16050 2/20 0.44
HTT P42858 2/20 0.44

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
SCHEMBL16484524 1.00 CYP2A6 (0.46) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL30109153 1.00 CYP2A6 (0.46) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL5102763 0.98 CYP2A6 (0.44) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL26849314 0.96 CYP2A6 (0.46) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL15606465 0.92 CYP2A6 (0.40) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL3141411 0.90 CYP2A6 (0.41) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL19801900 0.89 GRM5 (0.46) CYP2A6KDM4ECCR1CCR5CCR8
SCHEMBL16307352 0.89 GRM5 (0.43) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL15133751 0.89 CYP2A6 (0.40) CYP2A6LMNAKDM4ECCR1CCR5
SCHEMBL3133582 0.89 CYP2A6 (0.40) CYP2A6LMNAKDM4ECCR1CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210280804-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-09-09 US disclosed
US-20210280804-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-09-09 US disclosed
US-9682958-B2 Ligands and their preparation MERCK PATENT GMBH (DE) 2017-06-20 US disclosed
US-9682958-B2 Ligands and their preparation MERCK PATENT GMBH (DE) 2017-06-20 US disclosed
US-20150175574-A1 Ligands And Their Preparation MERCK PATENT GMBH (DE) 2015-06-25 US disclosed
US-20150175574-A1 Ligands And Their Preparation MERCK PATENT GMBH (DE) 2015-06-25 US disclosed
WO-2014015936-A1 LIGANDS AND THEIR PREPARATION MERCK PATENT GMBH (DE) 2014-01-30 WO disclosed
EP-1683804-B1 PLATINUM COMPLEX AND LUMINESCENT ELEMENT TAKASAGO PERFUMERY CO LTD (JP) 2013-07-31 EP disclosed
EP-1683804-B1 PLATINUM COMPLEX AND LUMINESCENT ELEMENT TAKASAGO PERFUMERY CO LTD (JP) 2013-07-31 EP disclosed
US-7442797-B2 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2008-10-28 US disclosed
US-7442797-B2 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2008-10-28 US disclosed
US-7442797-B2 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2008-10-28 US disclosed
US-20070103060-A1 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-05-10 US disclosed
US-20070103060-A1 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-05-10 US disclosed
US-20070103060-A1 Platinum complex and light emitting device TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-05-10 US disclosed
EP-1683804-A2 PLATINUM COMPLEX AND LUMINESCENT ELEMENT Takasago International Corporation (JP) 2006-07-26 EP 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 (3 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-20070103060-A1 Platinum complex and light emitting device UBE2D3, PCID2, CCND2 CYP2A6 3224/4885LMNA 3397/4885KDM4E 3127/4885
US-20210280804-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OTC CYP2A6 3356/4885LMNA 4558/4885KDM4E 3290/4885
US-20150175574-A1 Ligands And Their Preparation PNMT, DNMT1, DNMT3A CYP2A6 2487/4885LMNA 1969/4885KDM4E 2509/4885

“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.