SCHEMBL3611058

SCHEMBL3611058

CC1(C)COC(c2ccc(Cc3ccccc3)cc2)=N1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.61
CYP2D6 P10635 1/20 0.61
KDM4E B2RXH2 1/20 0.49
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.40
ATM Q13315 1/20 0.40
S1PR3 Q99500 1/20 0.39
CALM1 P0DP23 1/20 0.38
IL2 P60568 1/20 0.36

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
SCHEMBL10837608 0.85 KDM4E (0.56) HRH3CYP2D6KDM4ELMNAHTT
SCHEMBL342910 0.85 KDM4E (0.59) HRH3CYP2D6KDM4ELMNAHTT
Hydrochloric Acid SCHEMBL11553058 0.83 KDM4E (0.58) HRH3CYP2D6KDM4ELMNAHTT
SCHEMBL471858 0.83 KDM4E (0.60) HRH3CYP2D6KDM4ELMNAHTT
SCHEMBL668560 0.82 HRH3 (0.58) HRH3CYP2D6KDM4ELMNAHTT
Hydrochloric Acid SCHEMBL4777694 0.82 KDM4E (0.56) HRH3CYP2D6KDM4ELMNAHTT
Hydrochloric Acid SCHEMBL4777692 0.82 KDM4E (0.56) HRH3CYP2D6KDM4ELMNAHTT
SCHEMBL2088411 0.81 HRH3 (0.55) HRH3CYP2D6KDM4ELMNAMAPT
SCHEMBL6249892 0.81 HRH3 (0.52) HRH3CYP2D6KDM4ELMNAHTT
SCHEMBL20410717 0.81 KDM4E (0.51) HRH3CYP2D6KDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741044-B2 Libraries of oligomers labeled with different tags OXFORD GENE TECHNOLOGY IP LIMITED 2010-06-22 US disclosed
US-20090029866-A1 Libraries of oligomers labeled with different tags OXFORD GENE TECHNOLOGY IP LIMITED 2009-01-29 US disclosed
US-7399846-B2 Libraries of oligomers labeled with different tags OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2008-07-15 US disclosed
US-20050003408-A1 Libraries of oligomers labeled with different tags ISIS INNOVATION LIMITED (GB) 2005-01-06 US disclosed
US-6780981-B1 MAKING A SET OF LABELLED COMPOUNDS BY THE USE OF PARTICULATE SUPPORT, COMPRISES DIVIDING THE SUPPORT INTO LOTS, PERFORMING A DIFFERENT CHEMICAL REACTION ON EACH LOT OF THE SUPPORT OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2004-08-24 US disclosed
EP-1428810-A2 Libraries of oligomers labelled with different tags Oxford Gene Technology IP Limited (GB) 2004-06-16 EP disclosed
EP-1068216-B1 LIBRARIES OF OLIGOMERS LABELLED WITH DIFFERENT TAGS ISIS INNOVATION (GB) 2003-12-10 EP disclosed
EP-1068216-A2 LIBRARIES OF OLIGOMERS LABELLED WITH DIFFERENT TAGS ISIS INNOVATION LIMITED (GB) 2001-01-17 EP disclosed
WO-1999060007-A2 LIBRARIES OF OLIGOMERS LABELLED WITH DIFFERENT TAGS ISIS INNOVATION LIMITED (GB) 1999-11-25 WO 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-20090029866-A1 Libraries of oligomers labeled with different tags FBL, HNRNPL, MTREX HRH3 3048/4885CYP2D6 4687/4885KDM4E 2737/4885

“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.