SCHEMBL19170914

SCHEMBL19170914

CC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCC(=O)ON1C(=O)CCC1=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 8/20 0.35
▸ NPY5R Q15761 4/20 0.34
▸ NPY4R P50391 4/20 0.34
▸ NPY1R P25929 3/20 0.34
▸ NPY2R P49146 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ NMT2 O60551 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ SIRT5 Q9NXA8 1/20 0.32
▸ TLR2 O60603 1/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ ALB P02768 1/20 0.32

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
SCHEMBL19170915 0.93 FURIN (0.35) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL22767956 0.90 FURIN (0.34) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL21534490 0.90 FURIN (0.34) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL24336901 0.86 LMNA (0.35) FURINPOLB
SCHEMBL25488906 0.86 LMNA (0.35) FURINPOLB
SCHEMBL12629537 0.85 FURIN (0.37) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL12568288 0.85 FURIN (0.37) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL15870198 0.85 SMN1; SMN2 (0.43) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL30697716 0.85 FURIN (0.40) FURINNPY5RNPY4RNPY1RNPY2R
SCHEMBL10270090 0.84 FURIN (0.39) FURINNPY5RNPY4RNPY1RNPY2R

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
WO-2023178451-A1 ANTI-FOLATE RECEPTOR ALPHA ANTIBODIES AND METHODS OF USE ZYMEWORKS BC INC. (CA) 2023-09-28 — — WO disclosed
EP-3273998-B1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMA (US) 2019-09-04 — — EP disclosed
US-20170209591-A1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMACEUTICALS, INC. 2017-07-27 — — 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-20170209591-A1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE HNMT, SLC10A1, SLC10A2 FURIN 1025/4885NPY5R 461/4885NPY4R 505/4885

“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.

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