SCHEMBL6802599

SCHEMBL6802599

CCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 3/20 0.66
ALDH1A1 P00352 5/20 0.60
KMT2A Q03164 4/20 0.60
LMNA P02545 3/20 0.60
MEN1 O00255 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.59
POLB P06746 2/20 0.57
MAPT P10636 2/20 0.57
KDM4E B2RXH2 1/20 0.57
HSD17B10 Q99714 1/20 0.57
THRB P10828 1/20 0.55
GLA P06280 1/20 0.55
TSHR P16473 1/20 0.55
RAB9A P51151 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ATM Q13315 1/20 0.54

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
SCHEMBL6799325 1.00 FKBP1A (0.66) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL6801501 1.00 FKBP1A (0.66) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL20291018 0.88 ALDH1A1 (0.60) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL14417973 0.87 ALDH1A1 (0.73) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL21442025 0.86 LMNA (0.62) FKBP1AALDH1A1KMT2ALMNASMN1; SMN2
SCHEMBL6507941 0.85 ALDH1A1 (0.64) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL5717188 0.85 FKBP1A (0.63) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL5717045 0.84 FKBP1A (0.64) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL6917964 0.83 FKBP1A (0.66) FKBP1AALDH1A1KMT2ALMNAMEN1
SCHEMBL5717102 0.83 ALDH1A1 (0.64) FKBP1AALDH1A1KMT2ALMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6743787-B2 FOR THERAPY OF METABOLIC DISORDERS MEDIATED BY INSULIN RESISTANCE OR HYPERGLYCEMIA IN A MAMMAL WYETH 2004-06-01 US disclosed
US-20030027795-A1 N-(4-sulfonylaryl)cyclylamine-2-hydroxyethylamines as beta-3 adrenergic receptor agonists WYETH 2003-02-06 US disclosed
US-6444685-B1 THERAPY FOR METABOLISM DISEASES; DIETETICS; ANTIDIABETIC AGENTS WYETH 2002-09-03 US disclosed
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION 2002-03-07 US disclosed
WO-2002006274-A1 N-(4-SULFONYLARYL)CYCLYLAMINE-2-HYDROXYETHYLAMINES 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-20030027795-A1 N-(4-sulfonylaryl)cyclylamine-2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 FKBP1A 4191/4885ALDH1A1 2253/4885KMT2A 1041/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 FKBP1A 4013/4885ALDH1A1 1800/4885KMT2A 906/4885

“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.