SCHEMBL20188041

SCHEMBL20188041

CSCCC(N)C(=O)NCCCC(=O)NC(Cc1ccccn1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 10/20 0.46
FNTB P49356 10/20 0.46
PGGT1B P53609 9/20 0.46
CTSC P53634 1/20 0.41
HDAC6 Q9UBN7 4/20 0.40
HDAC1 Q13547 2/20 0.40
RAB9A P51151 1/20 0.40
TLR2 O60603 1/20 0.39
NPY1R P25929 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
SCHEMBL20188037 1.00 FNTA (0.46) FNTAFNTBPGGT1BCTSCHDAC6
SCHEMBL20188420 0.89 LTA4H (0.46) HDAC6HDAC1TLR2NPY1R
SCHEMBL20188418 0.89 LTA4H (0.46) HDAC6HDAC1TLR2NPY1R
SCHEMBL20187724 0.86 ALDH1A1 (0.43) HDAC6HDAC1TLR2NPY1R
SCHEMBL20187725 0.86 ALDH1A1 (0.43) HDAC6HDAC1TLR2NPY1R
SCHEMBL20188352 0.84 HDAC6 (0.43) HDAC6HDAC1NPY1R
SCHEMBL20187756 0.84 HDAC6 (0.43) HDAC6HDAC1NPY1R
SCHEMBL20187757 0.84 HDAC6 (0.43) HDAC6HDAC1NPY1R
SCHEMBL20188793 0.81 GPR88 (0.42) HDAC6HDAC1
SCHEMBL20188791 0.81 GPR88 (0.42) HDAC6HDAC1

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 FNTA 1801/4885FNTB 4376/4885PGGT1B 4138/4885
US-11358935-B2 Prodrugs of lanicemine and their method of use GRIN3A, GRIN1, GRM3 FNTA 1801/4885FNTB 4376/4885PGGT1B 4138/4885

“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.