SCHEMBL334284

SCHEMBL334284

CCN(CCN)[C@@H](C)c1ccccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.41
CXCR4 P61073 2/20 0.41
HSD11B1 P28845 4/20 0.37
P2RX7 Q99572 1/20 0.36
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
ACP3 P15309 1/20 0.34
CNR2 P34972 1/20 0.34
SLC6A2 P23975 2/20 0.33
SLC6A4 P31645 2/20 0.33
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
IDO1 P14902 2/20 0.33
MPO P05164 1/20 0.32
TDO2 P48775 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
SCHEMBL334855 0.83 MC4R (0.38) MC4RIDO1TDO2
SCHEMBL335997 0.80 ESR1 (0.36) MC4RCXCR4HTR2CHTR2BSLC6A2
SCHEMBL1133159 0.78 PGR (0.36)
SCHEMBL1132481 0.78 TSHR (0.36) IDO1TDO2
SCHEMBL10244104 0.77 HPGD (0.40) MC4RCNR2
SCHEMBL1132754 0.77 TAAR1 (0.41) MC4RIDO1TDO2
SCHEMBL334999 0.77 TAAR1 (0.41) MC4RIDO1TDO2
SCHEMBL335812 0.76 AOC3 (0.41)
SCHEMBL1132976 0.76 ALDH1A1 (0.42) HTR2CHTR2BSLC6A2
SCHEMBL9285913 0.75 MC4R (0.40) MC4RHSD11B1P2RX7CRHBPCRHR2

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 MC4R 3259/4885CXCR4 1537/4885HSD11B1 16/4885

“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.