SCHEMBL335368

SCHEMBL335368

CC(NCCN)c1ccc(-n2cnnn2)cc1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.59
ALDH1A1 P00352 2/20 0.57
MAPT P10636 3/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 1/20 0.44
F2 P00734 1/20 0.44
KCNJ1 P48048 2/20 0.43
POLB P06746 1/20 0.41
BLM P54132 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 3/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 2/20 0.39
RAB9A P51151 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL10245497 0.79 ALDH1A1 (0.52) NOTUMALDH1A1MAPTHTTKCNJ1
SCHEMBL18575578 0.76 HTR1A (0.50) ALDH1A1MAPTHTTLMNASMN1; SMN2
SCHEMBL10022325 0.75 NOTUM (1.00) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL18509374 0.73 NOTUM (0.70) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL12615985 0.71 NOTUM (0.78) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL21917710 0.71 NOTUM (0.66) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL18575438 0.70 SMN1; SMN2 (0.47) ALDH1A1MAPTHTTLMNATDP1
SCHEMBL24308192 0.69 ALDH1A1 (0.77) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL11768462 0.69 NOTUM (0.58) NOTUMALDH1A1MAPTHTTLMNA
SCHEMBL10730601 0.69 GAA (0.46) ALDH1A1MAPTHTTLMNAPOLB

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 NOTUM 2599/4885ALDH1A1 1939/4885MAPT 4302/4885

“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.