SCHEMBL5142107

SCHEMBL5142107

CC(C)(C)OC(=O)N(Cc1ccccc1)C1CCCc2cc(Cl)c(O)cc2C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.43
DRD2 P14416 5/20 0.41
DRD1 P21728 2/20 0.41
DRD5 P21918 1/20 0.41
AGER Q15109 1/20 0.39
HSP90AA1 P07900 1/20 0.38
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SIGMAR1 Q99720 4/20 0.36
DRD4 P21917 3/20 0.36
DRD3 P35462 3/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
CETP P11597 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL5143825 1.00 HSD11B1 (0.43) HSD11B1DRD2DRD1DRD5AGER
SCHEMBL5146612 0.89 HSD11B1 (0.42) HSD11B1DRD2AGERKMT2ACETP
SCHEMBL5143973 0.87 DRD2 (0.46) HSD11B1DRD2AGERKMT2ADRD4
SCHEMBL388656 0.87 HSD11B1 (0.45) HSD11B1DRD2AGERDRD4DRD3
SCHEMBL5145400 0.82 HSD11B1 (0.44) HSD11B1AGERJAK2JAK1CETP
SCHEMBL5144159 0.80 HSD11B1 (0.43) HSD11B1AGERHSP90AA1KMT2ACETP
SCHEMBL10207431 0.80 HSD11B1 (0.56) HSD11B1AGERKMT2AL3MBTL1JAK2
SCHEMBL5146713 0.79 HSD11B1 (0.42) HSD11B1CETPHTR2CSLC6A4
SCHEMBL5143634 0.79 ALOX15 (0.48) HSD11B1KMT2AL3MBTL1
SCHEMBL7753599 0.79 HSD11B1 (0.42) HSD11B1DRD2AGERJAK2JAK1

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 HSD11B1 1317/4885DRD2 141/4885DRD1 227/4885

“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.