SCHEMBL22423719

SCHEMBL22423719

C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)COCCOCCOCCNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]21)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)N[C@@H](CCCCN=[N+]=[N-])C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)[C@@H](C)O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 9/20 0.56
▸ CALCR P30988 9/20 0.56
▸ IL23R Q5VWK5 1/20 0.53
▸ KDM1A O60341 1/20 0.51
▸ MAOB P27338 1/20 0.51
▸ KDM5A P29375 1/20 0.51
▸ KDM1B Q8NB78 1/20 0.51
▸ GLP1R P43220 4/20 0.51
▸ GCGR P47871 4/20 0.51
▸ TFPI P10646 3/20 0.50
▸ PIN1 Q13526 1/20 0.50

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
SCHEMBL26346380 0.85 GLP1R (0.60) GLP1RGCGR
SCHEMBL24601727 0.85 GLP1R (0.60) GLP1RGCGR
SCHEMBL22550671 0.82 RAMP3 (0.53) RAMP3CALCRKDM1AMAOBKDM5A
SCHEMBL26209751 0.82 PLG (0.53) RAMP3CALCRKDM1AMAOBKDM5A
SCHEMBL26209740 0.81 APLNR (0.50) RAMP3CALCRKDM1AMAOBKDM5A
SCHEMBL12984646 0.80 RAMP3 (0.63) RAMP3CALCRTFPIPIN1
SCHEMBL24601848 0.80 APLNR (0.52) KDM1AMAOBKDM5AKDM1B
SCHEMBL12984102 0.80 RAMP3 (0.66) RAMP3CALCRIL23RGLP1RGCGR
Biotin SCHEMBL6521802 0.78 GLP1R (0.59) RAMP3CALCRGLP1RGCGRTFPI
SCHEMBL6176075 0.78 RAMP3 (0.52) RAMP3CALCR

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-20200291391-A1 CROSS-LINKED EPITOPES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. 2020-09-17 — — US disclosed
WO-2020186091-A1 CROSS-LINKED EPITOPES AND METHODS OF USE THEREOF INDI MOLECULAR, INC. (US) 2020-09-17 — — 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 (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-20200291391-A1 CROSS-LINKED EPITOPES AND METHODS OF USE THEREOF CD74, HLA-DRB1, HLA-C RAMP3 2393/4885CALCR 3060/4885IL23R 1580/4885

“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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