SCHEMBL4479167

SCHEMBL4479167

C[C@H](Cc1ccc(-c2ccc(CC(=O)O)cc2)cc1)NC[C@H](O)c1cccc(Cl)c1

nearest known ligand 0.80

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ADRB3 P13945 16/20 0.80
▸ ADRB1 P08588 13/20 0.80
▸ ADRB2 P07550 12/20 0.75
▸ ADRA1D P25100 2/20 0.72
▸ ADRA1A P35348 2/20 0.72
▸ ADRA1B P35368 2/20 0.72
▸ CYP2D6 P10635 2/20 0.72
▸ CYP1A2 P05177 1/20 0.72
▸ CYP2C9 P11712 1/20 0.72
▸ CYP2C19 P33261 1/20 0.72
▸ SLC2A1 P11166 2/20 0.71
▸ GLA P06280 1/20 0.65
▸ ADRA2A P08913 1/20 0.64
▸ ADRA2B P18089 1/20 0.64
▸ ADRA2C P18825 1/20 0.64
▸ CYP3A4 P08684 1/20 0.64
▸ HIF1A Q16665 1/20 0.64

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
Hydrochloric Acid SCHEMBL4472487 0.99 ADRB3 (0.78) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7149376 0.90 ADRB3 (0.81) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7207154 0.90 ADRB3 (0.81) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7149375 0.90 ADRB3 (0.81) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL9468416 0.89 ADRB3 (1.00) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL9468401 0.88 SLC2A1 (0.81) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL11273021 0.87 ADRB3 (0.77) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7148235 0.86 ADRB3 (0.96) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL7148233 0.86 ADRB3 (0.96) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL10433618 0.86 SLC2A1 (0.78) ADRB3ADRB1ADRB2ADRA1DADRA1A

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-7629366-B2 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2009-12-08 — — US disclosed
US-20060100252-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2006-05-11 — — US disclosed
US-7037938-B2 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2006-05-02 — — US disclosed
US-20040006143-A1 For therapy of urinary incontinence FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 — — 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-20060100252-A1 Aminoalcohol derivatives H1-0, CHRM2, CHRM1 ADRB3 130/4885ADRB1 39/4885ADRB2 40/4885
US-20040006143-A1 For therapy of urinary incontinence H1-0, HRH2, H1-2 ADRB3 568/4885ADRB1 256/4885ADRB2 123/4885

“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.

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