SCHEMBL6801401

SCHEMBL6801401

O=C1CCN(c2ccc(S(=O)(=O)NCc3cc(F)ccc3F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
KMT2A Q03164 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 2/20 0.47
LMNA P02545 2/20 0.47
GAA P10253 1/20 0.47
HBB P68871 1/20 0.47
NAMPT P43490 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTR1A P08908 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR7 P34969 1/20 0.41
CYP19A1 P11511 1/20 0.41

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
SCHEMBL6800331 0.81 NPC1 (0.47) KMT2ASMN1; SMN2MEN1LMNAGAA
SCHEMBL6799664 0.81 CYP19A1 (0.59) KMT2ASMN1; SMN2MEN1LMNANAMPT
SCHEMBL6800325 0.75 KEAP1 (0.58) USP2KMT2ASMN1; SMN2POLBALDH1A1
SCHEMBL6800428 0.74 MEN1 (0.43) KMT2ASMN1; SMN2MEN1ALDH1A1HTR2A
SCHEMBL6802861 0.73 ALDH1A1 (0.51) KMT2ASMN1; SMN2MEN1LMNAGAA
SCHEMBL6806959 0.71 NPC1 (0.57) KMT2ASMN1; SMN2MEN1ALDH1A1HTR2C
SCHEMBL6801365 0.71 ALDH1A1 (0.54) KMT2ASMN1; SMN2LMNAGAAMAPT
SCHEMBL6797196 0.71 GAA (0.54) KMT2ASMN1; SMN2MEN1LMNAGAA
SCHEMBL12530907 0.71 KMT2A (0.47) KMT2ASMN1; SMN2LMNANAMPTMAPT
SCHEMBL6793103 0.70 HTR7 (0.53) KMT2ASMN1; SMN2MEN1LMNAGAA

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-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

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 USP2 4320/4885KMT2A 1041/4885SMN1; SMN2 2820/4885
US-20020028797-A1 N-(4-sulfonylaryl)Cyclylamine 2-hydroxyethylamines as beta-3 adrenergic receptor agonists ADRB3, ADRB1, ADRB2 USP2 4239/4885KMT2A 906/4885SMN1; SMN2 2852/4885

“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.