SCHEMBL834237

SCHEMBL834237

CCOC(=O)c1ccc(-c2cnn3c(Br)cnc3c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 3/20 0.42
GAA P10253 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
MAOB P27338 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41

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
SCHEMBL836463 0.87 DYRK3 (0.48) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL836315 0.76 KDM4E (0.48) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL25422437 0.75 RAB9A (0.49) NPC1RAB9AMEN1KMT2APDGFRB
SCHEMBL836396 0.74 FGFR1 (0.43) NPC1MEN1KMT2APDGFRBPDGFRA
SCHEMBL15286166 0.74 MAPT (0.47) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL25420254 0.73 DYRK1A (0.41) NPC1RAB9AMEN1KMT2APDGFRB
SCHEMBL1965326 0.72 CA1 (0.73) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL16351874 0.72 CA1 (0.73) NPC1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL11130663 0.71 MKNK1 (0.53) NPC1RAB9AMEN1KMT2APDGFRB
SCHEMBL6705884 0.71 CA12 (0.61) NPC1RAB9AMEN1KMT2ASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143253-B2 Organic compounds NOVARTIS AG (CH) 2012-03-27 US disclosed
EP-2183027-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2011-08-31 EP disclosed
US-20100204235-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-08-12 US disclosed
EP-2183027-A1 ORGANIC COMPOUNDS Novartis Ag (CH) 2010-05-12 EP disclosed
WO-2009013335-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-01-29 WO 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-20100204235-A1 ORGANIC COMPOUNDS ALK, OR10J3, FFAR4 NPC1 743/4885RAB9A 3196/4885MEN1 2597/4885

“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.