SCHEMBL21458026

SCHEMBL21458026

CC(C)C[C@H](OC(N)=O)C(=O)N[C@@H](CCc1ccccc1)C(O)C(=O)NC1CC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46
METAP2 P50579 1/20 0.44
REN P00797 6/20 0.42
CAPN1 P07384 5/20 0.41
PSMB1 P20618 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
ERAP2 Q6P179 1/20 0.39
ERAP1 Q9NZ08 1/20 0.39
LNPEP Q9UIQ6 1/20 0.39
POLB P06746 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
SCHEMBL15299885 0.91 MEN1 (0.47) MEN1TSHRKMT2ARENCAPN1
SCHEMBL21458028 0.84 REN (0.49) RENCAPN1PSMB1
SCHEMBL3840760 0.84 REN (0.49) RENCAPN1PSMB1
SCHEMBL21458081 0.80 CAPN1 (0.66) RENCAPN1PSMB1
SCHEMBL21458079 0.80 CAPN1 (0.66) RENCAPN1PSMB1
SCHEMBL4401138 0.80 CAPN1 (0.66) RENCAPN1PSMB1
SCHEMBL21457988 0.78 CAPN1 (0.64) MEN1TSHRKMT2ACAPN1
SCHEMBL28028172 0.78 MEN1 (0.41) MEN1TSHRKMT2ARENCAPN1
SCHEMBL3842569 0.77 CTSK (0.52) KMT2AMETAP2
SCHEMBL30128799 0.76 CTSK (0.47) RENCAPN1PSMB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11844776-B2 Composition for treatment and/or prevention of peripheral nerve disorder OSAKA CITY UNIVERSITY (JP) 2023-12-19 US disclosed
US-20190314320-A1 COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PERIPHERAL NERVE DISORDER OSAKA CITY UNIVERSITY (JP) 2019-10-17 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 (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-20190314320-A1 COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PERIPHERAL NERVE DISORDER PMP22, PRPH, NGF MEN1 2693/4885TSHR 992/4885KMT2A 2235/4885
US-11844776-B2 Composition for treatment and/or prevention of peripheral nerve disorder PMP22, PRPH, NGF MEN1 2693/4885TSHR 992/4885KMT2A 2235/4885

“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.