SCHEMBL1622565

SCHEMBL1622565

CC(C)(C)OC(=O)N(CCc1ccc(-c2ccc(C(=O)O)c(C3CCCC3)c2)cc1)C[C@@H](OC1CCCCO1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 8/20 0.42
CAMKK2 Q96RR4 5/20 0.36
CAMKK1 Q8N5S9 4/20 0.36
ADRB1 P08588 1/20 0.36
OXTR P30559 2/20 0.35
AVPR1A P37288 2/20 0.35
MGLL Q99685 2/20 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
SCHEMBL1622561 1.00 ADRB3 (0.42) ADRB3CAMKK2CAMKK1ADRB1OXTR
SCHEMBL1622140 0.94 ADRB3 (0.42) ADRB3ADRB1OXTRAVPR1AMGLL
SCHEMBL1622138 0.94 ADRB3 (0.42) ADRB3ADRB1OXTRAVPR1AMGLL
SCHEMBL4584019 0.90 ADRB3 (0.41) ADRB3ADRB1
SCHEMBL4584022 0.90 ADRB3 (0.41) ADRB3ADRB1
SCHEMBL1622469 0.88 ADRB3 (0.46) ADRB3ADRB1
SCHEMBL1622471 0.88 ADRB3 (0.46) ADRB3ADRB1
SCHEMBL1622133 0.88 ADRB3 (0.46) ADRB3ADRB1OXTRAVPR1AMGLL
SCHEMBL1622131 0.88 ADRB3 (0.46) ADRB3ADRB1OXTRAVPR1AMGLL
SCHEMBL4584702 0.88 ADRB3 (0.51) ADRB3ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928264-B2 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2011-04-19 US disclosed
US-20080039506-A1 Aminoalcohol Derivatives ASTELLAS PHARMA INC. (JP) 2008-02-14 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 (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-20080039506-A1 Aminoalcohol Derivatives HRH4, HRH2, CBR3 ADRB3 40/4885CAMKK2 4669/4885CAMKK1 4778/4885

“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.