SCHEMBL334382

SCHEMBL334382

O=C(NCC[C@@H]1CO1)c1cccc(Br)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.62
HPGD P15428 1/20 0.60
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
LMNA P02545 1/20 0.54
TP53BP1 Q12888 1/20 0.53
ALDH1A1 P00352 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C19 P33261 2/20 0.53
CYP2C9 P11712 1/20 0.53
POLB P06746 1/20 0.51
MAPT P10636 3/20 0.50
TMEM97 Q5BJF2 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
GAA P10253 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL334813 0.92 L3MBTL1 (0.59) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL334661 0.91 LMNA (0.61) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL334352 0.90 LMNA (0.63) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL335221 0.86 HPGD (0.74) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL27483439 0.82 HPGD (0.54) HPGDNPC1RAB9ALMNAALDH1A1
SCHEMBL21616933 0.81 MEN1 (0.73) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL30673997 0.81 MEN1 (0.73) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL29818100 0.80 MEN1 (0.76) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL21617139 0.80 MEN1 (0.76) L3MBTL1HPGDNPC1RAB9AMEN1
SCHEMBL334404 0.78 NPC1 (0.47) HPGDNPC1KMT2AMAPTSIGMAR1

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 L3MBTL1 2853/4885HPGD 556/4885NPC1 209/4885

“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.