SCHEMBL5536670

SCHEMBL5536670

CCC(NC(CO)c1cccc(Cl)c1)c1ccccc1-c1ccc(OCC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 11/20 0.48
ADRB1 P08588 5/20 0.47
ADRB2 P07550 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1A P35348 1/20 0.47
ADRA1B P35368 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
EGLN2 Q96KS0 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 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
SCHEMBL5536663 0.82 ADRB3 (0.53) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL678588 0.75 ADRB3 (0.56) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL2338083 0.71 ADRB3 (0.60) ADRB3ADRB1ADRB2ADRA1DADRA1A
SCHEMBL29447016 0.67 LMNA (0.64)
SCHEMBL523934 0.67 LMNA (0.64)
Chlorobenzene SCHEMBL7068183 0.67 ALOX15 (0.80) ALDH1A1
Chlorobenzene SCHEMBL8616821 0.66 ALOX15 (0.71) ADRB3ADRB1ADRB2CYP1A2ALDH1A1
SCHEMBL7572345 0.65 ADRB3 (0.40) ADRB3ADRB1ADRB2
SCHEMBL1832083 0.65 ALOX15 (0.77) ALDH1A1
Alcohol SCHEMBL27641690 0.65 ALOX15 (0.83) ALDH1A1TSHR

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.