SCHEMBL2069658

SCHEMBL2069658

COC(c1ccc(-c2ccc(Cl)cc2)cc1)C1CCCNC1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 11/20 0.67
SLC6A2 P23975 10/20 0.49
SLC6A3 Q01959 9/20 0.49
CYP2D6 P10635 2/20 0.46

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
Hydrochloric Acid SCHEMBL15794108 0.79 SLC6A4 (0.97) SLC6A4SLC6A2SLC6A3
SCHEMBL14090989 0.78 SLC6A4 (0.71) SLC6A4SLC6A2SLC6A3
SCHEMBL2070575 0.77 SLC6A4 (0.41) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL2070640 0.76 SLC6A4 (0.46) SLC6A4SLC6A2SLC6A3
SCHEMBL14962107 0.75 SLC6A2 (0.65) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL5582525 0.75
SCHEMBL22778230 0.68 HTR3A (0.73) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL4479313 0.68 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3
SCHEMBL1866266 0.68 SLC6A2 (0.49) SLC6A4SLC6A2SLC6A3CYP2D6
SCHEMBL970753 0.67 SLC6A2 (0.51) SLC6A4SLC6A2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902367-B2 Cyclic amino benzoic acid derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-03-08 US disclosed
US-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2007-10-25 US disclosed
EP-1780210-A1 NOVEL CYCLIC AMINOBENZOIC ACID DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2007-05-02 EP 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-20070249580-A1 Novel Cyclic Amino Benzoic Acid Derivative PPARA, PPARG, PPARD SLC6A4 1813/4885SLC6A2 2893/4885SLC6A3 2049/4885

“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.