SCHEMBL334413

SCHEMBL334413

O=C(CCc1cccc(Br)c1)NC[C@@H]1CO1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.45
MAPT P10636 2/20 0.44
EPHX2 P34913 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
ALOX12 P18054 1/20 0.43
RAB9A P51151 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
PTPN1 P18031 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.41
CNR1 P21554 1/20 0.41
GLA P06280 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
SCHEMBL335312 0.86 AIMP2 (0.49) HPGDNPC1
SCHEMBL335234 0.79 NPC1 (0.53) MAPTKMT2AALDH1A1LMNAFFAR1
SCHEMBL9479297 0.77 HDAC6 (0.65) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL15637483 0.75 KMT2A (0.65) EPHX2KMT2ARAB9ACNR1
SCHEMBL335221 0.75 HPGD (0.74) HPGDMAPTKMT2AMEN1ALDH1A1
SCHEMBL24819999 0.74 CYP1A2 (0.54) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL30559640 0.74 TAAR1 (0.57) MAPTKMT2AMEN1ALDH1A1LMNA
SCHEMBL334404 0.74 NPC1 (0.47) HPGDMAPTKMT2ANPC1
SCHEMBL334890 0.74 NPC1 (0.47) HPGDMAPTKMT2ANPC1
SCHEMBL334943 0.72 NPC1 (0.45) HPGDALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
EP-1985620-A1 10a-AZALIDE COMPOUND TAISHO PHARMACEUTICAL CO., LTD (JP) 2008-10-29 EP 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-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 HPGD 556/4885MAPT 4302/4885EPHX2 2656/4885

“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.