SCHEMBL4463319

SCHEMBL4463319

CC1(C)OB(c2ccc(CCN(Cc3ccccc3)C(=O)O)cc2)OC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 8/20 0.51
LPL P06858 7/20 0.51
F11 P03951 2/20 0.50
F2 P00734 1/20 0.50
PRSS1 P07477 1/20 0.50
PRSS2 P07478 1/20 0.50
PRSS3 P35030 1/20 0.50
RCE1 Q9Y256 1/20 0.46
P4HB P07237 1/20 0.44
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 1/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR5 Q9H1C0 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CA12 O43570 2/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CA4 P22748 1/20 0.41
MEN1 O00255 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
SCHEMBL27635300 0.86 F2 (0.46) LIPGLPLF11F2PRSS1
SCHEMBL534958 0.81 NPSR1 (0.39) LIPGLPLRCE1L3MBTL1MEN1
SCHEMBL17468510 0.79 P4HB (0.44) LIPGLPLF11F2PRSS1
SCHEMBL12031512 0.79 LIPG (0.59) LIPGLPLF11P4HB
SCHEMBL7228409 0.78 MEN1 (0.61) RCE1CA1CA2L3MBTL1CA12
SCHEMBL2718768 0.78 LIPG (0.52) LIPGLPLF11F2PRSS1
SCHEMBL16247340 0.78 P4HB (0.51) LIPGLPLF11F2PRSS1
SCHEMBL2595120 0.78 LIPG (0.52) LIPGLPLF11F2PRSS1
SCHEMBL410785 0.77 LIPG (0.51) LIPGLPLF11F2PRSS1
SCHEMBL1684669 0.76 LIPG (0.53) LIPGLPLF11F2PRSS1

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-7629366-B2 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2009-12-08 US disclosed
US-20060100252-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2006-05-11 US disclosed
US-7037938-B2 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2006-05-02 US disclosed
US-20040006143-A1 For therapy of urinary incontinence FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-08 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-20060100252-A1 Aminoalcohol derivatives H1-0, CHRM2, CHRM1 LIPG 3791/4885LPL 4015/4885F11 567/4885
US-20040006143-A1 For therapy of urinary incontinence H1-0, HRH2, H1-2 LIPG 4786/4885LPL 4774/4885F11 619/4885

“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.