SCHEMBL20340684

SCHEMBL20340684

CCC(C)(C)C(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCCCCN1C(=O)C=CC1=O)C(C)C

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FAP Q12884 5/20 0.37
▸ NPY4R P50391 4/20 0.34
▸ NPY5R Q15761 4/20 0.34
▸ NPY1R P25929 3/20 0.34
▸ NPY2R P49146 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ PTGS1 P23219 4/20 0.33
▸ PTGS2 P35354 4/20 0.33
▸ NMT2 O60551 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ FURIN P09958 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ TLR2 O60603 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
SCHEMBL18909025 0.92 FAP (0.37) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL22694922 0.92 FAP (0.37) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL22267878 0.92 FAP (0.37) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL24780979 0.89 NMT1 (0.44) NPY4RNPY5RNPY1RNPY2RNMT2
SCHEMBL18932364 0.89 FAP (0.38) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL29308956 0.89 NPY5R (0.40) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL19170785 0.88 SIRT5 (0.33) FAPFURIN
SCHEMBL26058204 0.88 FAP (0.37) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL25094826 0.88 FAP (0.37) FAPNPY4RNPY5RNPY1RNPY2R
SCHEMBL23256221 0.88 NPY5R (0.38) FAPNPY4RNPY5RNPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11446389-B2 Maytansinoid derivatives, conjugates thereof, and methods of use REGENERON PHARMACEUTICALS, INC. (US) 2022-09-20 — — US disclosed
US-20220089772-A1 ANTI-GLYCO-MUC1 ANTIBODIES AND THEIR USES GO THERAPEUTICS, INC. (US) 2022-03-24 — — US disclosed
US-20200121806-A1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE REGENERON PHARMACEUTICALS, INC. 2020-04-23 — — US disclosed
US-10011657-B2 Anti-CS1 antibodies and antibody drug conjugates ABBVIE BIOTHERAPEUTICS INC. (US) 2018-07-03 — — 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 (4 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-10011657-B2 Anti-CS1 antibodies and antibody drug conjugates CD47, CSGALNACT1, CSE1L FAP 4279/4885NPY4R 4779/4885NPY5R 4707/4885
US-20220089772-A1 ANTI-GLYCO-MUC1 ANTIBODIES AND THEIR USES MUC1, SIGLEC7, SIGLEC9 FAP 1009/4885NPY4R 4459/4885NPY5R 4578/4885
US-20200121806-A1 MAYTANSINOID DERIVATIVES, CONJUGATES THEREOF, AND METHODS OF USE HNMT, SLC10A1, SLC10A2 FAP 696/4885NPY4R 505/4885NPY5R 461/4885
US-11446389-B2 Maytansinoid derivatives, conjugates thereof, and methods of use HNMT, SLC10A1, SLC10A2 FAP 696/4885NPY4R 505/4885NPY5R 461/4885

“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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