SCHEMBL4010491

SCHEMBL4010491

Cc1ccccc1NC(=O)CN1CCN(c2ccccn2)CC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.77
MEN1 O00255 7/20 0.76
POLB P06746 1/20 0.75
ALDH1A1 P00352 7/20 0.74
SMN1; SMN2 Q16637 3/20 0.74
THRB P10828 1/20 0.70
NPSR1 Q6W5P4 1/20 0.70
MAPT P10636 3/20 0.70
DRD2 P14416 4/20 0.67
DRD4 P21917 4/20 0.67
DRD3 P35462 3/20 0.67
LMNA P02545 2/20 0.66
HBB P68871 1/20 0.66
GFER P55789 1/20 0.63
TSHR P16473 2/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62

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
SCHEMBL4010416 0.91 POLB (0.84) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL4006361 0.88 DRD2 (0.71) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL6173210 0.85 ALDH1A1 (1.00) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL11001390 0.84 DRD2 (0.68) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL4004192 0.83 MAPK1 (0.80) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL4003722 0.83 KMT2A (1.00) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL4008925 0.83 THRB (1.00) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL11004965 0.82 KMT2A (0.56) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL14125406 0.81 ALDH1A1 (0.77) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL4003932 0.81 DRD2 (1.00) KMT2AMEN1ALDH1A1SMN1; SMN2THRB

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
EP-1509213-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION Abbott Laboratories (US) 2005-03-02 EP claimed
US-20040029887-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2004-02-12 US claimed
US-20030229094-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2003-12-11 US claimed
WO-2003099266-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION ABBOTT LABORATORIES (US) 2003-12-04 WO claimed
US-7528134-B2 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES INC. (US) 2009-05-05 US disclosed
US-20060009461-A1 Acetamides and benzamides that are useful in treating sexual dysfunction BHATIA PRAMILA A 2006-01-12 US disclosed
EP-1509213-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION Abbott Laboratories (US) 2005-03-02 EP disclosed
US-20040029887-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2004-02-12 US disclosed
US-20030232836-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2003-12-18 US disclosed
US-20030229094-A1 Acetamides and benzamides that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2003-12-11 US disclosed
WO-2003099266-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION ABBOTT LABORATORIES (US) 2003-12-04 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 (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-20030229094-A1 Acetamides and benzamides that are useful in treating sexual dysfunction CATSPER1, CYP19A1, PDE12 KMT2A 2169/4885MEN1 2828/4885POLB 3627/4885
US-20040029887-A1 Acetamides and benzamides that are useful in treating sexual dysfunction CATSPER1, CYP19A1, PDE12 KMT2A 2169/4885MEN1 2828/4885POLB 3627/4885
US-20060009461-A1 Acetamides and benzamides that are useful in treating sexual dysfunction PDE12, NAAA, CYP19A1 KMT2A 1792/4885MEN1 3823/4885POLB 3383/4885
US-20030232836-A1 Acetamides and benzamides that are useful in treating sexual dysfunction CATSPER1, CYP19A1, PDE12 KMT2A 2169/4885MEN1 2828/4885POLB 3627/4885

“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.