SCHEMBL6490053

SCHEMBL6490053

NC(=O)c1ccc2c(Oc3ccc(C[C@@H](CO)NCC(O)COc4ccccc4)cc3)ccnc2c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 11/20 0.53
ADRB1 P08588 11/20 0.53
MET P08581 6/20 0.40
AXL P30530 2/20 0.39
MERTK Q12866 2/20 0.39
LMNA P02545 1/20 0.38
ADRB2 P07550 1/20 0.38
CNR1 P21554 1/20 0.38
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL6490059 1.00 ADRB3 (0.53) ADRB3ADRB1METAXLMERTK
SCHEMBL6479456 0.94 ADRB3 (0.58) ADRB3ADRB1METAXLMERTK
SCHEMBL6479461 0.94 ADRB3 (0.58) ADRB3ADRB1METAXLMERTK
SCHEMBL7687080 0.91 ADRB3 (0.52) ADRB3ADRB1METAXLMERTK
SCHEMBL7687077 0.91 ADRB3 (0.52) ADRB3ADRB1METAXLMERTK
SCHEMBL7689875 0.91 ADRB3 (0.52) ADRB3ADRB1METAXLMERTK
SCHEMBL7693483 0.90 ADRB3 (0.57) ADRB3ADRB1METADRB2TDP1
SCHEMBL6478777 0.89 ADRB3 (0.51) ADRB3ADRB1METAXL
SCHEMBL6478782 0.89 ADRB3 (0.51) ADRB3ADRB1METAXL
SCHEMBL7692667 0.89 ADRB3 (0.50) ADRB3ADRB1METAXLMERTK

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-20050043358-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-02-24 US disclosed
US-20020143034-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2002-10-03 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-20020143034-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists ADRB1, ADRB2, ADRB3 ADRB3 3/4885ADRB1 1/4885MET 2453/4885
US-20050043358-A1 Aminoalcohol derivatives and their use as beta 3 adrenergic agonists ADRB2, ADRB1, ADRB3 ADRB3 3/4885ADRB1 2/4885MET 2555/4885

“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.