SCHEMBL335818

SCHEMBL335818

O=C(NCCC[C@@H]1CO1)Nc1cccc(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
GOT1 P17174 1/20 0.47
GAA P10253 1/20 0.45
CNR1 P21554 1/20 0.44
EPHX1 P07099 3/20 0.44
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HCRTR1 O43613 1/20 0.43
HCRTR2 O43614 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PKM P14618 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL334273 0.82 SMN1; SMN2 (0.54) MAPTGAAEGFRALDH1A1HTT
SCHEMBL334813 0.80 L3MBTL1 (0.59) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL21805651 0.79 EGFR (0.58) MAPTGOT1GAACNR1EPHX1
SCHEMBL334943 0.78 NPC1 (0.45) GAAEGFRERBB2ALDH1A1
SCHEMBL334661 0.76 LMNA (0.61) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL6690632 0.76 EGFR (0.64) MAPTGOT1GAACNR1EPHX1
SCHEMBL334352 0.75 LMNA (0.63) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL19707566 0.72 GAA (0.65) MAPTGAAALDH1A1HTTMEN1
SCHEMBL10690705 0.72 EPHX1 (0.40) EPHX1ALDH1A1
SCHEMBL11908700 0.72 GAA (0.66) MAPTGOT1GAAEGFRALDH1A1

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 MAPT 4302/4885GOT1 4102/4885GAA 551/4885

“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.