SCHEMBL5146589

SCHEMBL5146589

NC1CCCc2ccc(OCC(=O)Nc3ccccc3)cc2C1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
ALDH1A1 P00352 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
RAB9A P51151 7/20 0.53
NPC1 O15118 5/20 0.53
ADORA3 P0DMS8 1/20 0.49
ADORA2A P29274 1/20 0.49
LMNA P02545 1/20 0.49
HDAC8 Q9BY41 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL5143860 0.83 MAPT (0.53) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL5679222 0.78 SMN1; SMN2 (0.55) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL5142036 0.78 MAPT (0.50) MAPTALDH1A1L3MBTL1RAB9ANPC1
Hydrochloric Acid SCHEMBL5679236 0.77 SMN1; SMN2 (0.54) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL3098041 0.77 HRH3 (0.62) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL5145659 0.77 ACHE (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2ALOX15
SCHEMBL5143747 0.76 ACHE (0.48) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL8765782 0.76 ADRB3 (0.55) MAPTALDH1A1L3MBTL1RAB9ANPC1
SCHEMBL5722323 0.76 HSD17B10 (0.62) MAPTALDH1A1ALOX15TSHRHSD17B10
SCHEMBL5722321 0.76 HSD17B10 (0.62) MAPTALDH1A1ALOX15TSHRHSD17B10

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 MAPT 2069/4885ALDH1A1 335/4885L3MBTL1 1712/4885

“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.