SCHEMBL6074256

SCHEMBL6074256

O=S(=O)(Nc1ccc(N2CCC(NCC(O)c3cccc(O)c3)CC2)cc1)c1ccc(Oc2ncc(C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.54
SMN1; SMN2 Q16637 6/20 0.54
HTT P42858 3/20 0.54
MAPT P10636 3/20 0.54
XBP1 P17861 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
POLB P06746 1/20 0.49
ALDH1A1 P00352 5/20 0.45
PTGES2 Q9H7Z7 1/20 0.45
RAB9A P51151 1/20 0.42
HPGD P15428 2/20 0.42
ADRB1 P08588 5/20 0.41
ADRB3 P13945 5/20 0.41
ADRB2 P07550 4/20 0.41
SCN9A Q15858 1/20 0.39
FAAH O00519 1/20 0.38
KDM4E B2RXH2 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6074409 0.85 SMN1; SMN2 (0.59) LMNASMN1; SMN2HTTMAPTXBP1
SCHEMBL6074028 0.82 KMT2A (0.51) LMNAHTTMAPTMEN1KMT2A
SCHEMBL6074869 0.82 ADRB3 (0.55) LMNASMN1; SMN2HTTMAPTXBP1
SCHEMBL6074655 0.77 KMT2A (0.50) LMNAHTTMAPTMEN1KMT2A
SCHEMBL6074649 0.77 KMT2A (0.50) LMNAHTTMAPTMEN1KMT2A
SCHEMBL6074750 0.77 LMNA (0.69) LMNASMN1; SMN2HTTMAPTXBP1
SCHEMBL6074802 0.77 ADRB3 (0.47) MAPTMEN1KMT2AALDH1A1ADRB1
SCHEMBL6074990 0.77 ADRB3 (0.54) LMNAHTTMAPTNPSR1POLB
SCHEMBL6074597 0.74 KMT2A (0.55) LMNASMN1; SMN2HTTMAPTMEN1
SCHEMBL6074604 0.74 KMT2A (0.55) LMNASMN1; SMN2HTTMAPTMEN1

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
US-7022716-B2 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH (US) 2006-04-04 US claimed
US-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2003-07-31 US claimed
EP-1301482-A1 CYCLIC AMINE PHENYL BETA-3 ADRENERGIC RECEPTOR AGONISTS Wyeth (US) 2003-04-16 EP claimed
US-20020028835-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2002-03-07 US claimed
WO-2002006232-A1 CYCLIC AMINE PHENYL BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 WO claimed
US-7022716-B2 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH (US) 2006-04-04 US disclosed
US-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2003-07-31 US disclosed
EP-1301482-A1 CYCLIC AMINE PHENYL BETA-3 ADRENERGIC RECEPTOR AGONISTS Wyeth (US) 2003-04-16 EP disclosed
US-6525202-B2 E.g., substituted (4-amino-5-hydroxyphenyl)-oxy-)piperidinyl thiazolidin-2,4-dione; antidiabetic agents; atherosclerosis, gastrointestinal, metabolic disorders, glaucoma, neurogenetic inflammation, ocular hypertension and frequent urination WYETH 2003-02-25 US disclosed
US-20020028835-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2002-03-07 US disclosed
WO-2002006232-A1 CYCLIC AMINE PHENYL BETA-3 ADRENERGIC RECEPTOR AGONISTS WYETH (US) 2002-01-24 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 (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-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 LMNA 2593/4885SMN1; SMN2 3999/4885HTT 1722/4885
US-20020028835-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 LMNA 2593/4885SMN1; SMN2 3999/4885HTT 1722/4885

“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.