SCHEMBL6358223

SCHEMBL6358223

COc1ccc(N2CCN(CCC(=O)c3ccccc3)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 6/20 1.00
KMT2A Q03164 3/20 0.88
MEN1 O00255 2/20 0.88
SOD1 P00441 1/20 0.78
POLB P06746 2/20 0.77
DRD2 P14416 1/20 0.69
HTR2A P28223 1/20 0.69
ALDH1A1 P00352 2/20 0.67
MAPT P10636 1/20 0.67
HTT P42858 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.66
THRA P10827 1/20 0.64
THRB P10828 1/20 0.64

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
SCHEMBL351997 0.86 HTR1A (0.81) HTR1AKMT2AMEN1DRD2HTR2A
SCHEMBL5011458 0.85 KMT2A (0.75) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL6359231 0.82 HTR1A (0.70) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL6359232 0.82 HTR1A (0.70) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL14374505 0.81 KMT2A (0.72) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL3161414 0.80 KMT2A (0.67) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL16026463 0.80 KMT2A (0.83) HTR1AKMT2AALDH1A1MAPT
SCHEMBL11828184 0.80 HTR1A (0.66) HTR1AKMT2AMEN1SOD1POLB
SCHEMBL11823680 0.80 HTR1A (0.66) HTR1AKMT2AMEN1SOD1POLB
Hydrochloric Acid SCHEMBL5358803 0.80 DRD3 (0.66) HTR1AKMT2AMEN1POLBDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 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-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 HTR1A 871/4885KMT2A 1762/4885MEN1 3181/4885

“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.