SCHEMBL5143652

SCHEMBL5143652

COc1ccc2c(c1)CCCC(N(Cc1ccccc1)C[C@H](O)COc1ccccc1)C2

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
DRD2 P14416 5/20 0.47
DRD3 P35462 4/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
PRMT5 O14744 2/20 0.46
WDR77 Q9BQA1 2/20 0.46
POLB P06746 1/20 0.43
DRD4 P21917 3/20 0.43
ADRB3 P13945 1/20 0.41
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL5143959 0.96 ALDH1A1 (0.48) ALDH1A1TSHRDRD2DRD3MEN1
SCHEMBL5144161 0.91 DRD2 (0.45) ALDH1A1TSHRDRD2DRD3MEN1
SCHEMBL5143855 0.90 PRMT5 (0.47) ALDH1A1TSHRDRD2MEN1KMT2A
SCHEMBL5146546 0.89 PRMT5 (0.46) ALDH1A1TSHRDRD2DRD3MEN1
SCHEMBL5146452 0.88 PRMT5 (0.48) ALDH1A1TSHRDRD2MEN1KMT2A
SCHEMBL5143739 0.88 PRMT5 (0.46) ALDH1A1TSHRDRD2DRD3MEN1
SCHEMBL5143628 0.87 PRMT5 (0.45) ALDH1A1TSHRMEN1KMT2APRMT5
SCHEMBL5144084 0.87 PRMT5 (0.46) ALDH1A1TSHRPRMT5WDR77POLB
SCHEMBL5142021 0.87 MAPT (0.45) ALDH1A1TSHRDRD2DRD3MEN1
SCHEMBL5143641 0.86 PRMT5 (0.44) ALDH1A1TSHRDRD2MEN1KMT2A

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 ALDH1A1 335/4885TSHR 4148/4885DRD2 141/4885

“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.