SCHEMBL20187752

SCHEMBL20187752

NCC(=O)NCCCC(=O)NC(Cc1ccccn1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
HDAC6 Q9UBN7 4/20 0.44
HDAC1 Q13547 2/20 0.44
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
NCOA1 Q15788 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
PTPRA P18433 1/20 0.41
ITGB3 P05106 2/20 0.41
ITGAV P06756 2/20 0.41
ITGA2B P08514 1/20 0.41
ITGB5 P18084 1/20 0.41
ITGB6 P18564 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
SCHEMBL20188716 0.90 SMN1; SMN2 (0.47) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20189083 0.87 HDAC6 (0.48) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL9321384 0.87 GRIN2D (0.51) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20187756 0.84 HDAC6 (0.43) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20188352 0.84 HDAC6 (0.43) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20187757 0.84 HDAC6 (0.43) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20188420 0.83 LTA4H (0.46) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20188418 0.83 LTA4H (0.46) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20187725 0.83 ALDH1A1 (0.43) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B
SCHEMBL20187724 0.83 ALDH1A1 (0.43) SMN1; SMN2HDAC6HDAC1GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11358935-B2 Prodrugs of lanicemine and their method of use BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) 2022-06-14 US claimed
US-20200299238-A1 PRODRUGS OF LANICEMINE AND THEIR METHOD OF USE BIOHAVEN THERAPEUTICS LTD. 2020-09-24 US claimed
WO-2018098344-A1 PRODRUGS OF LANICEMINE AND THEIR METHOD OF USE BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) 2018-05-31 WO claimed
US-11358935-B2 Prodrugs of lanicemine and their method of use BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) 2022-06-14 US disclosed
US-20200299238-A1 PRODRUGS OF LANICEMINE AND THEIR METHOD OF USE BIOHAVEN THERAPEUTICS LTD. 2020-09-24 US disclosed
WO-2018098344-A1 PRODRUGS OF LANICEMINE AND THEIR METHOD OF USE BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) 2018-05-31 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 (2 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-20200299238-A1 PRODRUGS OF LANICEMINE AND THEIR METHOD OF USE GRIN3A, GRIN1, GRM3 SMN1; SMN2 3011/4885HDAC6 2369/4885HDAC1 222/4885
US-11358935-B2 Prodrugs of lanicemine and their method of use GRIN3A, GRIN1, GRM3 SMN1; SMN2 3011/4885HDAC6 2369/4885HDAC1 222/4885

“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.