SCHEMBL335261

SCHEMBL335261

CCn1nccc1C(C)NCCN

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.38
CPB2 Q96IY4 4/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
RAB9A P51151 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 2/20 0.33
CCNK O75909 1/20 0.31
CDK12 Q9NYV4 1/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CPB1 P15086 1/20 0.30
CHRM2 P08172 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
ADORA3 P0DMS8 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
SCHEMBL334651 0.82 CYP3A4 (0.33) CPB2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10244130 0.76 RAB9A (0.38) IDH1HCRTR1HCRTR2RAB9AMEN1
SCHEMBL23970832 0.74 IDH1 (0.35) IDH1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL2737250 0.74 IDH1 (0.39) IDH1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL24664412 0.69 MAPK1 (0.34) IDH1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL12473308 0.68 SIGMAR1 (0.35) KMT2ACYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL10730601 0.66 GAA (0.46) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL25619104 0.66 MAPK1 (0.36) ALDH1A1HTR2B
SCHEMBL335380 0.66 MEN1 (0.43) RAB9AMEN1KMT2ASMN1; SMN2NPC1
Bromide SCHEMBL28277639 0.66 ALDH1A1 (0.41) IDH1RAB9AMEN1KMT2ASMN1; SMN2

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 IDH1 4373/4885CPB2 2043/4885HCRTR1 3325/4885

“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.