SCHEMBL7092162

SCHEMBL7092162

CCNC(=O)N1CCC(Nc2ccc(CCN)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 1/20 0.51
TPSD1 Q9BZJ3 1/20 0.51
TPSG1 Q9NRR2 1/20 0.51
MAPT P10636 1/20 0.48
ADRB3 P13945 8/20 0.48
KMT2A Q03164 1/20 0.47
ADRB1 P08588 6/20 0.47
MLNR O43193 3/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA13 Q8N1Q1 1/20 0.46
CA14 Q9ULX7 1/20 0.46
MAPK8 P45983 2/20 0.44
MAPK9 P45984 2/20 0.44
MAPK10 P53779 1/20 0.44

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
Formic Acid SCHEMBL7095073 0.95 TPSAB1 (0.47) TPSAB1TPSD1TPSG1MAPTADRB3
SCHEMBL7095127 0.87 ADRB3 (0.62) TPSAB1TPSD1TPSG1ADRB3ADRB1
SCHEMBL7095565 0.87 ADRB3 (0.50) TPSAB1TPSD1TPSG1MAPTADRB3
Formic Acid SCHEMBL7096055 0.84 TPSAB1 (0.54) TPSAB1TPSD1TPSG1ADRB3ADRB1
SCHEMBL7091755 0.84 TPSAB1 (0.51) TPSAB1TPSD1TPSG1ADRB3KMT2A
Formic Acid SCHEMBL7095796 0.84 ADRB3 (0.61) TPSAB1TPSD1TPSG1ADRB3ADRB1
SCHEMBL7094555 0.83 ADRB1 (0.60) TPSAB1TPSD1TPSG1ADRB3KMT2A
SCHEMBL7091850 0.83 TPSAB1 (0.53) TPSAB1TPSD1TPSG1ADRB3ADRB1
Formic Acid SCHEMBL7096122 0.83 ADRB3 (0.55) TPSAB1TPSD1TPSG1MAPTADRB3
SCHEMBL7091774 0.81 ADRB1 (0.58) MAPTADRB3ADRB1MLNRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605618-B2 Antidiabetic agents; hypoglycemic agents; anticholesterol agents; side effect reduction WYETH 2003-08-12 US disclosed
US-20030018045-A1 Heterocyclic beta-3 adrenergic receptor agonists WYETH (US) 2003-01-23 US disclosed
US-6451814-B1 SUBSTITUTED 4-((4-AMINO-5-HYDROXYPHENYL)-OXY-)PIPERIDINE ANALOGS; METABOLIC DISORDERS; ANTIDIABETIC AGENTS; ATHERO-SCLEROSIS, GASTROINTESTINAL DISORDERS, GLAUCOMA, NEUROGENETIC INFLAMMATION, OCULAR HYPERTENSION AND FREQUENT URINATION WYETH 2002-09-17 US disclosed
US-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-07 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 (2 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-20030018045-A1 Heterocyclic beta-3 adrenergic receptor agonists ADRB2, ADRB1, ADRB3 TPSAB1 596/4885TPSD1 651/4885TPSG1 947/4885
US-20020028832-A1 Heterocyclic beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 TPSAB1 518/4885TPSD1 580/4885TPSG1 1098/4885

“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.