SCHEMBL1299524

SCHEMBL1299524

c1ccc(CCCN2CCN([C@H]3CCCc4ccccc43)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.59
GRIN2B Q13224 3/20 0.58
SIGMAR1 Q99720 6/20 0.55
GRIN1 Q05586 1/20 0.54
DRD3 P35462 2/20 0.53
HTR1A P08908 1/20 0.53
CHRNA7 P36544 1/20 0.52

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
SCHEMBL1299103 1.00 HTR2C (0.59) HTR2CGRIN2BSIGMAR1GRIN1DRD3
SCHEMBL1299100 1.00 HTR2C (0.59) HTR2CGRIN2BSIGMAR1GRIN1DRD3
Hydrochloric Acid SCHEMBL1298856 0.99 HTR2C (0.58) HTR2CGRIN2BSIGMAR1GRIN1DRD3
Hydrochloric Acid SCHEMBL1299210 0.99 HTR2C (0.58) HTR2CGRIN2BSIGMAR1GRIN1DRD3
Hydrochloric Acid SCHEMBL1298852 0.99 HTR2C (0.58) HTR2CGRIN2BSIGMAR1GRIN1DRD3
SCHEMBL8091911 0.96 GRIN2B (0.57) HTR2CGRIN2BSIGMAR1GRIN1DRD3
SCHEMBL7684151 0.96 GRIN2B (0.57) HTR2CGRIN2BSIGMAR1GRIN1DRD3
SCHEMBL8091907 0.96 GRIN2B (0.57) HTR2CGRIN2BSIGMAR1GRIN1DRD3
SCHEMBL2166535 0.92 SIGMAR1 (0.58) GRIN2BSIGMAR1GRIN1
SCHEMBL2165836 0.92 SIGMAR1 (0.58) GRIN2BSIGMAR1GRIN1

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-20110269775-A1 Piperazine derivatives M'S SCIENCE CORPORATION 2011-11-03 US claimed

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-20110269775-A1 Piperazine derivatives SIGMAR1, OPRK1, OPRL1 HTR2C 92/4885GRIN2B 55/4885SIGMAR1 1/4885

“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.