SCHEMBL4818709

SCHEMBL4818709

COc1ccccc1N1CCN(Cc2cc3ccccc3n2C)CC1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
LMNA P02545 1/20 0.58
HTT P42858 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
HTR7 P34969 4/20 0.58
HTR1A P08908 1/20 0.58
DRD2 P14416 4/20 0.57
DRD3 P35462 3/20 0.57
DRD4 P21917 2/20 0.57
HRH2 P25021 2/20 0.57
HRH1 P35367 1/20 0.57
HRH3 Q9Y5N1 1/20 0.56
MAPK1 P28482 1/20 0.55
TSHR P16473 1/20 0.55
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL4152680 0.77 GRM2 (0.71) KDM4ELMNADRD2DRD4MAPK1
SCHEMBL807593 0.76 FAAH (0.57) KDM4ETSHRALDH1A1
SCHEMBL9225440 0.74 MAPK1 (0.81) KDM4ELMNAHTTTDP1HTR7
SCHEMBL6526368 0.74 DRD2 (0.85) HTR7HTR1ADRD2DRD3ALDH1A1
Hydrochloric Acid SCHEMBL7694029 0.74 KDM4E (0.60) KDM4ELMNAHTTTDP1HTR7
SCHEMBL8363314 0.73 DRD2 (0.77) HTR7HTR1ADRD2DRD3KMT2A
SCHEMBL3261221 0.73 DRD2 (1.00) HTR7HTR1ADRD2DRD3KMT2A
SCHEMBL31060769 0.73 DRD2 (1.00) HTR7HTR1ADRD2DRD3KMT2A
SCHEMBL15937713 0.73 HTR7 (1.00) KDM4ELMNAHTTTDP1HTR7
SCHEMBL6908666 0.73 MAPK1 (0.69) KDM4ELMNAHTTTDP1HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070265249-A1 Fused Bicyclic Aromatic Compounds that are Useful in Treating Sexual Dysfunction ABBVIE INC. 2007-11-15 US claimed
US-20060172995-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBVIE INC. 2006-08-03 US claimed
US-20040063713-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBVIE INC. 2004-04-01 US claimed
US-20040002488-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction WEINSTOCK, STEVEN F. 2004-01-01 US claimed
US-7470691-B2 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBOTT LABORATORIES (US) 2008-12-30 US disclosed
US-20070265249-A1 Fused Bicyclic Aromatic Compounds that are Useful in Treating Sexual Dysfunction ABBVIE INC. 2007-11-15 US disclosed
US-7235661-B2 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBOTT LABORATORIES (US) 2007-06-26 US disclosed
US-20060172995-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBVIE INC. 2006-08-03 US disclosed
US-7057042-B2 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBOTT LABORATORIES (US) 2006-06-06 US disclosed
US-20040063713-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction ABBVIE INC. 2004-04-01 US disclosed
US-20040002488-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction WEINSTOCK, STEVEN F. 2004-01-01 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 (4 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-20040063713-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction CYP19A1, CYP17A1, HSD17B11 KDM4E 3657/4885LMNA 4670/4885HTT 4537/4885
US-20070265249-A1 Fused Bicyclic Aromatic Compounds that are Useful in Treating Sexual Dysfunction CYP19A1, CYP17A1, HSD17B11 KDM4E 2778/4885LMNA 2277/4885HTT 4523/4885
US-20060172995-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction CYP19A1, CYP17A1, DDC KDM4E 2026/4885LMNA 3391/4885HTT 4437/4885
US-20040002488-A1 Fused bicyclic aromatic compounds that are useful in treating sexual dysfunction CYP19A1, CYP17A1, HSD17B11 KDM4E 3657/4885LMNA 4670/4885HTT 4537/4885

“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.