SCHEMBL4575724

SCHEMBL4575724

CSc1nc(NC(=O)c2ccc(Cl)c(Cl)c2)c(C(=O)O)n1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
DGAT1 O75907 1/20 0.40
MAPK8 P45983 2/20 0.39
ACHE P22303 1/20 0.39
MAOB P27338 1/20 0.39
PTGS2 P35354 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
SLC16A3 O15427 1/20 0.39

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
SCHEMBL13325146 0.88 ADORA3 (0.48) RAB9AKDM4EMAPTIRAK4MAPK8
SCHEMBL4576546 0.88 PTGS2 (0.49) MEN1KMT2ANPC1RAB9APTGS2
SCHEMBL4575931 0.83 PPARG (0.45) KDM4EIRAK4ADORA3
SCHEMBL4576936 0.82 ADORA3 (0.49) KMT2ANPC1RAB9AMAPTADORA3
SCHEMBL4577097 0.78 HPGD (0.42) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL4576968 0.77 NPC1 (0.47) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL13325145 0.76 ALDH1A1 (0.46) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL13325140 0.75 ADORA3 (0.51) RAB9AKDM4EIRAK4ADORA3
SCHEMBL3284471 0.75 SMN1; SMN2 (0.44) MEN1KMT2AMAPK8PTGS2ADORA3
SCHEMBL3288851 0.74 PTGS2 (0.45) MEN1KMT2ANPC1RAB9AMAPK8

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-20080269216-A1 Imidazole Variants as Modulators of Gaba Receptor For the Treatment of Gi Disorders ASTRAZENECA AB (SE) 2008-10-30 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-20080269216-A1 Imidazole Variants as Modulators of Gaba Receptor For the Treatment of Gi Disorders GABRB1, GABBR2, GABBR1 MEN1 4338/4885KMT2A 2837/4885NPC1 2613/4885

“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.