SCHEMBL12608124

SCHEMBL12608124

CCN(C)CCNC(C)(C)c1ccccc1SC

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.32
PRMT1 Q99873 1/20 0.32
CHRM2 P08172 1/20 0.31
ADRA1D P25100 1/20 0.30
ADRA1A P35348 1/20 0.30
ADRA1B P35368 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL1132168 0.77 HPGD (0.35) HPGDCHRM2ADRA1DADRA1AADRA1B
SCHEMBL12608409 0.77 CHRM2 (0.38) CHRM2KMT2A
SCHEMBL12609110 0.77 ALDH1A1 (0.31)
SCHEMBL12609255 0.75 KCNN4 (0.40) CHRM2KMT2A
SCHEMBL12608085 0.70 CHRNB2 (0.38)
SCHEMBL12609231 0.69 HSD11B1 (0.37)
SCHEMBL12566221 0.65 KDM4E (0.38) HPGDKMT2A
SCHEMBL9885328 0.64 ALDH1A1 (0.46) HPGDCHRM2KMT2A
SCHEMBL18563148 0.64
SCHEMBL25735130 0.64 MAPK1 (0.36) HPGDCHRM2KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299035-B2 10a-azalide compound having 4-membered ring structure TAISHO PHARMACEUTUCAL CO., LTD. (JP) 2012-10-30 US disclosed
US-20110152239-A1 10A-AZALIDE COMPOUND HAVING 4-MEMBERED RING STRUCTURE TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-06-23 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-20110152239-A1 10A-AZALIDE COMPOUND HAVING 4-MEMBERED RING STRUCTURE ELOVL3, ELOVL5, SCD5 HPGD 1961/4885PRMT1 2726/4885CHRM2 3997/4885

“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.