SCHEMBL7246502

SCHEMBL7246502

CC(=O)c1ccc(C[C@@H](CO)N(Cc2ccccc2)C[C@H](O)COc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.48
MAPT P10636 4/20 0.48
NPSR1 Q6W5P4 2/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 4/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
ABCB1 P08183 5/20 0.44
MAOB P27338 1/20 0.43
HTR7 P34969 1/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
TSHR P16473 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL7037437 0.90 ALDH1A1 (0.52) POLBMAPTNPSR1LMNAALDH1A1
SCHEMBL6478257 0.86 POLB (0.50) POLBMAPTNPSR1LMNAALDH1A1
SCHEMBL6539389 0.85 POLB (0.44) POLBMAPTNPSR1LMNAALDH1A1
SCHEMBL6538577 0.85 POLB (0.49) POLBMAPTNPSR1LMNAALDH1A1
SCHEMBL6538633 0.85 POLB (0.49) POLBMAPTNPSR1LMNAALDH1A1
SCHEMBL6538732 0.84 ADRB1 (0.50) LMNAADRB1ADRB3
SCHEMBL6540060 0.84 ADRB1 (0.48) POLBLMNAADRB1ADRB3
SCHEMBL6538563 0.84 ADRB1 (0.54) LMNAADRB1ADRB3
SCHEMBL6538833 0.84 ADRB3 (0.61) POLBMAPTALDH1A1MAPK1ADRB1
SCHEMBL6538889 0.83 ADRB1 (0.49) LMNAALDH1A1GAATSHRADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073846-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-04-17 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-20030073846-A1 Aminoalcohol derivatives XDH, ADH1A, ADRB1 POLB 1141/4885MAPT 3887/4885NPSR1 1351/4885

“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.