SCHEMBL10244776

SCHEMBL10244776

CCCCNC(=O)c1cccc2ncccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.64
HTT P42858 2/20 0.59
TSHR P16473 1/20 0.59
HPGD P15428 3/20 0.52
RXFP1 Q9HBX9 2/20 0.49
ESR2 Q92731 2/20 0.49
NR4A1 P22736 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NAAA Q02083 1/20 0.48
FAP Q12884 1/20 0.48
TP53 P04637 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
PREP P48147 1/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
GAA P10253 2/20 0.47
GLA P06280 1/20 0.47
POLB P06746 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
SCHEMBL31047590 0.95 NSD2 (0.61) NSD2HTTTSHRHPGDESR2
SCHEMBL31047570 0.95 NSD2 (0.61) NSD2HTTTSHRHPGDESR2
SCHEMBL10243020 0.90 HTT (0.60) NSD2HTTTSHRHPGDRXFP1
SCHEMBL27844476 0.82 TSHR (0.60) HTTTSHRHPGDRXFP1SMN1; SMN2
SCHEMBL10245901 0.82 HTT (0.56) HTTTSHRHPGDRXFP1ESR2
SCHEMBL10244761 0.81 SMN1; SMN2 (0.49) HTTTSHRHPGDRXFP1SMN1; SMN2
SCHEMBL12396143 0.81 NSD2 (0.67) NSD2HTTESR2NR4A1SMN1; SMN2
SCHEMBL6358755 0.80 HTT (0.66) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL161560 0.80 HTT (0.66) HTTTSHRHPGDSMN1; SMN2NAAA
SCHEMBL10245917 0.80 TSHR (0.60) HTTTSHRHPGDSMN1; SMN2NAAA

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 4 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-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
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US 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 NSD2 677/4885HTT 868/4885TSHR 1567/4885

“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.