SCHEMBL5536663

SCHEMBL5536663

C[C@H](Cc1ccccc1-c1ccc(OCC(=O)O)cc1)N[C@@H](CO)c1cccc(Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 15/20 0.53
ADRB1 P08588 11/20 0.53
ADRB2 P07550 7/20 0.53
CYP2D6 P10635 2/20 0.53
ADRA1D P25100 1/20 0.53
ADRA1A P35348 1/20 0.53
ADRA1B P35368 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.43
HIF1A Q16665 1/20 0.43
ADAMTS4 O75173 1/20 0.42
ADAMTS5 Q9UNA0 1/20 0.42

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
SCHEMBL5536670 0.82 ADRB3 (0.48) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL7207159 0.74 ADRB3 (0.55) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL2338083 0.70 ADRB3 (0.60) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL9630134 0.70 ADRB3 (0.66) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL302999 0.69 ADRB3 (1.00) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL304309 0.69 ADRB3 (1.00) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL304308 0.69 ADRB3 (1.00) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL302998 0.69 ADRB3 (1.00) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL3692642 0.69 ADRB3 (1.00) ADRB3ADRB1ADRB2CYP2D6ADRA1D
SCHEMBL10774911 0.69 ADRB3 (0.71) ADRB3ADRB1ADRB2CYP2D6ADRA1D

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-20070232698-A1 Slimming Skin External Preparation and Cosmetic Containing the Same SHOWA DENKO K.K. (JP) 2007-10-04 US claimed
US-5626854-A XANTHINE OR B-ADRENERGIC STIMULANT KAO CORPORATION (JP) 1997-05-06 US claimed
US-20070232698-A1 Slimming Skin External Preparation and Cosmetic Containing the Same SHOWA DENKO K.K. (JP) 2007-10-04 US disclosed
WO-2001068137-A2 COMPOSITIONS FOR REGULATING MEMORY CONSOLIDATION BROWN UNIVERSITY RESEARCH FOUNDATION (US) 2001-09-20 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-20070232698-A1 Slimming Skin External Preparation and Cosmetic Containing the Same CPT1B, CUTA, LPL ADRB3 1007/4885ADRB1 533/4885ADRB2 1058/4885

“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.