SCHEMBL335329

SCHEMBL335329

CC(NCCN)c1ccc(OCC(=O)N2CCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
FKBP1A P62942 1/20 0.53
RAB9A P51151 4/20 0.52
POLB P06746 2/20 0.52
HPGD P15428 2/20 0.52
MAPT P10636 1/20 0.52
LMNA P02545 1/20 0.51
KDM4E B2RXH2 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 2/20 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
SCHEMBL334936 0.90 FKBP1A (0.69) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL10245484 0.85 ALDH1A1 (0.53) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL14725172 0.79 FKBP1A (0.75) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL335399 0.78 SMN1; SMN2 (0.49) ALDH1A1RAB9AHPGDLMNAKDM4E
SCHEMBL10243876 0.76 FKBP1A (0.65) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL335085 0.76 NPC1 (0.51) ALDH1A1RAB9APOLBMAPTLMNA
SCHEMBL8284320 0.72 RAB9A (0.72) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL335348 0.71 RAB9A (0.66) ALDH1A1RAB9APOLBHPGDMAPT
SCHEMBL13849630 0.71 FKBP1A (0.76) ALDH1A1FKBP1ARAB9APOLBHPGD
SCHEMBL18575578 0.71 HTR1A (0.50) ALDH1A1MAPTLMNAKMT2A

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 ALDH1A1 1939/4885FKBP1A 2222/4885RAB9A 5/4885

“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.