SCHEMBL6985012

SCHEMBL6985012

CCCCNc1ccc(S(=O)(=O)N2CC(NCc3ccccc3)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
ADRB3 P13945 2/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
FABP6 P51161 1/20 0.41
ADAM17 P78536 1/20 0.41
TGM2 P21980 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
EBP Q15125 1/20 0.41
DHCR7 Q9UBM7 1/20 0.41
NAMPT P43490 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL6983340 0.83 ADRB3 (0.59) ADRB3ADRB2ADRB1MAPTMEN1
SCHEMBL6980419 0.75 KMT2A (0.55) ALDH1A1SMN1; SMN2ADRB3ADRB2ADRB1
SCHEMBL22868374 0.75 MEN1 (0.54) ALDH1A1TGM2LMNAGAAMEN1
SCHEMBL6983011 0.73 HSD11B1 (0.44) ALDH1A1TGM2LMNAGAAMAPT
SCHEMBL22868400 0.72 GAA (0.74) ALDH1A1POLBGAAMEN1KMT2A
SCHEMBL27576780 0.72 ALDH1A1 (0.39) ALDH1A1TGM2LMNAGAAMAPT
SCHEMBL1926283 0.72 HTT (0.61) ALDH1A1SMN1; SMN2CA12CA1CA2
SCHEMBL27594975 0.71 EBP (0.41) ADRB3ADRB2ADRB1FABP6EBP
SCHEMBL20492814 0.67 FABP6 (0.62) SMN1; SMN2FABP6EBPDHCR7MEN1
SCHEMBL5923863 0.66 PTGS2 (0.52) POLBCA1CA2CA9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6649603-B2 For therapy of metabolic disorders related to insulin resistance or hyperglycemia WYETH 2003-11-18 US disclosed
CN-1455769-A Cyclic amine sulfonamides as beta-3 adrenergic receptor agonists WYETH LTD (US) 2003-11-12 CN disclosed
EP-1328512-A2 CYCLYLAMINE SULFONAMIDES AS BETA-3 ADRENERGIC RECEPTOR AGONISTS Wyeth (US) 2003-07-23 EP disclosed
US-20030027797-A1 Cyclylamine sulfonamides as beta-3 adrenergic receptor agonists WYETH (US) 2003-02-06 US disclosed
US-6498170-B2 4-((2S)-3-(1-(4-BUTOXY-BENZENESULFONYL)-AZETIDIN-3-YLAMINO)-2 -HYDROXY- PROPOXY)-PHENOL FOR EXAMPLE; HYPOGLYCEMIC AGENT; INCREASING LEAN MEAT TO FAT RATIO IN MAMMALS WYETH 2002-12-24 US disclosed
US-20020022605-A1 Cyclamine sulfonamides as beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-02-21 US disclosed
WO-2002006221-A2 CYCLYLAMINE SULFONAMIDES AS 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-20020022605-A1 Cyclamine sulfonamides as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 ALDH1A1 3013/4885SMN1; SMN2 2197/4885ADRB3 1/4885
US-20030027797-A1 Cyclylamine sulfonamides as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 ALDH1A1 2651/4885SMN1; SMN2 2485/4885ADRB3 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.