SCHEMBL20680392

SCHEMBL20680392

Cc1cc(Br)cc2c(Cl)cc(=O)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 2/20 0.38
GSK3B P49841 1/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 3/20 0.37
HPGD P15428 2/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GRIN2D O15399 1/20 0.34
GRIN3B O60391 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
GRIN2C Q14957 1/20 0.34
GRIN3A Q8TCU5 1/20 0.34
NQO2 P16083 4/20 0.34
CYP19A1 P11511 3/20 0.34

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
SCHEMBL1128687 0.84 NQO2 (0.47) MAPTSMN1; SMN2LMNAGSK3BTP53
SCHEMBL23117477 0.79 MAPT (0.46) MAPTSMN1; SMN2LMNATP53KDM4E
SCHEMBL9431360 0.74 KDM4E (0.61) MAPTLMNAKDM4EHPGDALDH1A1
SCHEMBL16167174 0.71 GSK3B (0.39) MAPTSMN1; SMN2LMNAGSK3BKDM4E
SCHEMBL25433555 0.71 MAPT (0.38) MAPTKDM4EGRIN2DGRIN3BGRIN1
SCHEMBL3208633 0.69 GSK3B (0.38) LMNAGSK3BHPGDHSD17B10GRIN2D
SCHEMBL29974598 0.69 EIF4A3 (0.42) MAPTKDM4EGRIN2DGRIN3BGRIN1
SCHEMBL27164027 0.69 EIF4A3 (0.42) MAPTKDM4EGRIN2DGRIN3BGRIN1
SCHEMBL23117491 0.68 CD38 (0.56) MAPT
SCHEMBL5674822 0.68 AHR (0.48) MAPTLMNAGSK3BKDM4EHPGD

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-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2021-03-25 US disclosed
EP-3658586-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2020-06-03 EP disclosed
WO-2019020643-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES ENCEFA (FR) 2019-01-31 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-20210087290-A1 COMPOUNDS WHICH SPECIFICALLY BIND TO CD38 FOR USE IN THE TREATMENT OF NEURODEGENERATIVE AND INFLAMMATORY DISEASES CD38, TRPC1, TRPC4 MAPT 636/4885SMN1; SMN2 1111/4885LMNA 925/4885

“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.