SCHEMBL12608591

SCHEMBL12608591

CCN(C)[C@@H](CO)CNC(C)(C)c1ccccc1OC

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
AGTR1 P30556 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
CASR P41180 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
GAA P10253 1/20 0.33
CRHBP P24387 1/20 0.32
CRHR2 Q13324 1/20 0.32
ADRB2 P07550 2/20 0.32
ADRB1 P08588 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 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
SCHEMBL12609236 0.82 LMNA (0.36) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL1132931 0.79 AGTR1 (0.38) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL12608429 0.78 MEN1 (0.36) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL1132372 0.77 AGTR1 (0.37) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL1132369 0.77 AGTR1 (0.37) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL12608414 0.77 LMNA (0.35) ALDH1A1MEN1KMT2ALMNAAGTR1
SCHEMBL27679895 0.76 CA1 (0.39) ALDH1A1MEN1KMT2AMAPTATM
SCHEMBL12609061 0.74 CA1 (0.40) MEN1KMT2ALMNAAGTR1CYP1A2
SCHEMBL1986850 0.74 KMT2A (0.38) ALDH1A1MEN1KMT2AMAPTGAA
SCHEMBL12608409 0.73 CHRM2 (0.38) ALDH1A1MEN1KMT2ALMNAATM

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 ALDH1A1 3050/4885MEN1 3582/4885KMT2A 695/4885

“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.