SCHEMBL13352425

SCHEMBL13352425

CCCOCOc1ccc(CC(=O)N2CCC3(CC2)CN/C(=N\C(=O)c2nc(I)c(N)nc2N)N3)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 7/20 0.37
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CHRM2 P08172 4/20 0.31
MC4R P32245 1/20 0.30
PANK3 Q9H999 1/20 0.30
MAPT P10636 1/20 0.30
CYP3A4 P08684 1/20 0.30
HTR2B P41595 1/20 0.30
KCNH2 Q12809 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
SCHEMBL12303768 0.93 GHSR (0.34) GHSRSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL13321376 0.92 GHSR (0.37) GHSRSMN1; SMN2MEN1KMT2ACHRM2
SCHEMBL12238987 0.87 YAP1 (0.39) MEN1KMT2AKCNH2
SCHEMBL12824794 0.86 ME2 (0.38) GHSRMEN1KMT2A
SCHEMBL14553783 0.86 GHSR (0.33) GHSRSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL1684602 0.85 SCNN1A (0.36) GHSRSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL2142417 0.85 SCNN1A (0.37) GHSRMEN1KMT2ACHRM2PANK3
SCHEMBL12238991 0.84 MEN1 (0.39) MEN1KMT2AL3MBTL1
SCHEMBL12215593 0.84 GHSR (0.36) GHSRSMN1; SMN2HPGDNPSR1HSD17B10
SCHEMBL12239812 0.83 NPY5R (0.33) MC4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130506-A1 Organic Compounds NOVARTIS AG 2010-05-27 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-20100130506-A1 Organic Compounds OR10J3, REN, CACNA1E GHSR 1249/4885SMN1; SMN2 1712/4885MEN1 854/4885

“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.