SCHEMBL10243815

SCHEMBL10243815

COC(=O)NCCNC(C)c1ccc(-n2ccc(=O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
ACACB O00763 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
RRM1 P23921 1/20 0.32
MTNR1B P49286 3/20 0.32
MTNR1A P48039 2/20 0.32
GFER P55789 1/20 0.32
MAPK1 P28482 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL334441 0.79 KMT2A (0.41) KMT2AALDH1A1SMN1; SMN2TDP1GFER
SCHEMBL10244285 0.78 ESR1 (0.42) ALDH1A1ACACBSMN1; SMN2RRM1PKM
SCHEMBL10244535 0.78 KMT2A (0.37) KMT2AALDH1A1ACACBSMN1; SMN2
SCHEMBL10244023 0.77 HDAC3 (0.46) KMT2AALDH1A1ACACB
SCHEMBL10243724 0.75 KMT2A (0.44) KMT2AALDH1A1ACACBSMN1; SMN2
SCHEMBL10245497 0.75 ALDH1A1 (0.52) KMT2AALDH1A1SMN1; SMN2POLBTDP1
SCHEMBL10243779 0.75 ACACB (0.44) KMT2AALDH1A1ACACB
SCHEMBL10244071 0.74 TSHR (0.36) KMT2AALDH1A1ACACBSMN1; SMN2RRM1
SCHEMBL10243646 0.74 EPHX2 (0.41) KMT2ASMN1; SMN2
SCHEMBL10243978 0.73 ALDH1A1 (0.51) ALDH1A1MAPK1

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 KMT2A 939/4885ALDH1A1 1939/4885ACACB 4596/4885

“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.