SCHEMBL4824352

SCHEMBL4824352

N#Cc1cccc(CSc2ccccc2C2=NCCCN2)c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NISCH Q9Y2I1 3/20 0.42
CTSB P07858 1/20 0.42
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
DAO P14920 1/20 0.41
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40
CNR2 P34972 1/20 0.40
TP53 P04637 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL4819238 0.87 SMN1; SMN2 (0.50) MAOBNISCHCTSBGAATSHR
SCHEMBL4068865 0.85 L3MBTL1 (0.46) MAOBL3MBTL1NISCHGAATSHR
SCHEMBL4070724 0.84 NISCH (0.51) L3MBTL1NISCHGAATSHR
SCHEMBL4159436 0.84 NISCH (0.49) L3MBTL1NISCHDAOGAATSHR
SCHEMBL4071760 0.84 L3MBTL1 (0.63) MAOBL3MBTL1NISCHGAATSHR
SCHEMBL4069362 0.84 L3MBTL1 (0.46) MAOBL3MBTL1NISCHGSK3AGSK3B
Bromide SCHEMBL4909528 0.83 NISCH (0.50) L3MBTL1NISCHGAATSHR
SCHEMBL4068101 0.81 NPC1 (0.47) L3MBTL1NISCHCTSBDAOTP53
SCHEMBL4823948 0.81 NISCH (0.45) L3MBTL1NISCHDAOGAATSHR
SCHEMBL4820152 0.81 ALDH1A1 (0.49) NISCHGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-10-30 US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
US-7375125-B2 Melanocortin-4 receptor binding compounds and methods of use thereof ORE PHARMACEUTICALS, INC. (US) 2008-05-20 US disclosed
US-6699873-B1 EATING DISORDERS MILLENNIUM PHARMACEUTICALS, INC. 2004-03-02 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-20080269217-A1 Melanocortin-4 receptor binding compounds and methods of use thereof MC4R, MC5R, MC3R MAOB 486/4885L3MBTL1 326/4885NISCH 1934/4885

“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.