SCHEMBL14749775

SCHEMBL14749775

COc1ccc(C)c(OCC2(C(=O)O)CCC2)c1OC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 5/20 0.40
▸ MGLL Q99685 5/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAPT P10636 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MIF P14174 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ BRD4 O60885 1/20 0.34

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
SCHEMBL14750017 0.88 DGAT1 (0.39) DGAT1MGLLTDP1MAPTMEN1
SCHEMBL14749776 0.86 L3MBTL1 (0.42) ALDH1A1GAASMN1; SMN2L3MBTL1MAPT
SCHEMBL14750025 0.78 MGLL (0.41) DGAT1MGLL
SCHEMBL14749736 0.76 ALDH1A1 (0.48) ALDH1A1GAAMEN1KMT2AMIF
SCHEMBL14734815 0.74 KDR (0.38) DGAT1
SCHEMBL16784835 0.74 SMN1; SMN2 (0.53) TDP1ALDH1A1GAASMN1; SMN2L3MBTL1
SCHEMBL14750672 0.73 TDP1 (0.41) TDP1ALDH1A1GAASMN1; SMN2L3MBTL1
SCHEMBL14734749 0.72 PDE4D (0.39) ALDH1A1SMN1; SMN2MEN1KMT2AHPGD
SCHEMBL17599609 0.70 ALDH1A1 (0.50) ALDH1A1GAASMN1; SMN2MEN1KMT2A
SCHEMBL14749777 0.70 CYP2C9 (0.55) DGAT1TDP1ALDH1A1GAASMN1; SMN2

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-9051290-B2 Biaryl phosphodiesterase inhibitors LEO PHARMA A/S (DK) 2015-06-09 — — US disclosed
US-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2013-03-07 — — 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-20130059853-A1 BIARYL PHOSPHODIESTERASE INHIBITORS PDE3B, PDE3A, PDE4A DGAT1 942/4885MGLL 254/4885TDP1 49/4885

“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.

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