SCHEMBL5146605

SCHEMBL5146605

O=C(CO)NCC(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 5/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
GAA P10253 1/20 0.35
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.33

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
SCHEMBL31121771 0.84 LMNA (0.39) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL21691028 0.80 NAAA (0.41) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL5463077 0.80 PGK1 (0.32) LMNAPOLBSMN1; SMN2ALDH1A1
SCHEMBL15271725 0.79 LMNA (0.39) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL3903991 0.77 SMN1; SMN2 (0.41) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL22616333 0.77 LMNA (0.38) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL3372700 0.77 LMNA (0.38) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL1290037 0.77 SMN1; SMN2 (0.48) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL981619 0.77 LMNA (0.38) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1
SCHEMBL2035994 0.77 KDM4E (0.39) LMNAPOLBSMN1; SMN2KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7217706-B2 Propanolamine derivatives ASTELLAS PHARMA INC. (JP) 2007-05-15 US disclosed
EP-1382333-A2 Use of beta 3 adrenergic receptor agonists in the treatment of dysuria FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-21 EP disclosed
US-6495546-B1 SUCH AS 1-(N-BENZYL-N-(3-METHOXY-6,7,8,9-TETRAHYDRO-5H-BENZO-CYCLOHEPTEN-6-YL)AMINO)-3-PHENOXY-2-PROPANOL; ADRENERGIC RECEPTOR AGONISTS; ANTIULCEROUS, LIPOLYTIC, ANTIURINARY INCONTINENCE AND ANTIPOLLAKIURIA ACTIVITIES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-12-17 US disclosed
US-20020120148-A1 Propanolamine derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-08-29 US disclosed
EP-1070046-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-24 EP disclosed
WO-1999051564-A1 PROPANOLAMINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-10-14 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 (1 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-20020120148-A1 Propanolamine derivatives AMY2A, PNMT, PNLIP LMNA 1888/4885POLB 1386/4885SMN1; SMN2 853/4885

“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.