SCHEMBL7565615

SCHEMBL7565615

CCc1ccnc2c1ccc1c(CC)ccnc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.50
CCR5 P51681 4/20 0.50
CCR8 P51685 4/20 0.50
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
L3MBTL1 Q9Y468 4/20 0.38
NPC1 O15118 2/20 0.38
HSP90AA1 P07900 1/20 0.38
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
NOS3 P29474 2/20 0.34
NOS2 P35228 2/20 0.34
NOS1 P29475 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL9526032 0.85 CCR1 (0.62) CCR1CCR5CCR8KDM4ELMNA
SCHEMBL19725754 0.83 KDM4E (0.50) KDM4ELMNATP53MAPTTSHR
SCHEMBL7772851 0.81 KDM4E (0.45) CCR1CCR5CCR8KDM4ELMNA
SCHEMBL12728621 0.80 HTR1A (0.57) CCR1CCR5CCR8KDM4ELMNA
SCHEMBL31026580 0.79 CCR1 (0.43) CCR1CCR5CCR8KDM4ELMNA
SCHEMBL10005371 0.79 CCR1 (0.43) CCR1CCR5CCR8KDM4ELMNA
SCHEMBL13064178 0.78 NR4A2 (0.56) CCR1CCR8KDM4ELMNATP53
SCHEMBL7567056 0.78 MAPT (0.46) KDM4ELMNATP53MAPTTSHR
SCHEMBL13064176 0.78 KDM4E (0.46) KDM4ELMNATP53MAPTTSHR
SCHEMBL1714724 0.78 KDM4E (0.74) KDM4ELMNATP53MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-04-12 US disclosed
US-9871206-B2 Compound, organic electroluminescence device material, organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 US disclosed
US-20140077191-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2014-03-20 US disclosed
EP-0813608-B1 OSMIUM-CONTAINING REDOX MEDIATOR ROCHE DIAGNOSTICS CORP (US) 2002-09-04 EP disclosed
EP-0813608-A4 OSMIUM-CONTAINING REDOX MEDIATOR ROCHE DIAGNOSTICS CORP (US) 2000-02-09 EP disclosed
US-5846702-A Reagent including an osmium-containing redox mediator BOEHRINGER MANNHEIM CORPORATION (US) 1998-12-08 US disclosed
EP-0813608-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1997-12-29 EP disclosed
US-5589326-A FOR ELECTROCHEMICAL BIOSENSORS BOEHRINGER MANNHEIM CORPORATION (US) 1996-12-31 US disclosed
WO-1996025514-A1 OSMIUM-CONTAINING REDOX MEDIATOR BOEHRINGER MANNHEIM CORPORATION (US) 1996-08-22 WO disclosed
EP-0292898-B1 POLYAMINES AS ADJUVANT FOR LIQUID ELECTROSTATIC DEVELOPERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-02-03 EP disclosed
EP-0292898-A2 Polyamines as adjuvant for liquid electrostatic developers E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-11-30 EP disclosed
US-4780388-A STABILIZED ELECTROCONDUCTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-10-25 US 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 (1 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-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE CBX8, MLX, HAX1 CCR1 233/4885CCR5 698/4885CCR8 37/4885

“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.