SCHEMBL29833875

SCHEMBL29833875

CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O

nearest known ligand 0.75

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.75
▸ GNRHR P30968 3/20 0.69
▸ ABCC2 Q92887 1/20 0.67
▸ KISS1R Q969F8 1/20 0.52
▸ NMBR P28336 2/20 0.51
▸ GRPR P30550 2/20 0.51
▸ CAPN1 P07384 1/20 0.50
▸ CTSB P07858 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
SCHEMBL29833831 1.00 PTGS1 (0.75) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833876 1.00 PTGS1 (0.75) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833884 1.00 PTGS1 (0.75) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833863 1.00 PTGS1 (0.75) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833848 1.00 PTGS1 (0.75) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833852 0.96 PTGS1 (0.69) PTGS1GNRHRABCC2
SCHEMBL29833864 0.96 PTGS1 (0.69) PTGS1GNRHRABCC2
SCHEMBL29833882 0.96 PTGS1 (0.70) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29833873 0.96 PTGS1 (0.70) PTGS1GNRHRABCC2KISS1RNMBR
SCHEMBL29584427 0.96 PTGS1 (0.71) PTGS1GNRHRABCC2NMBRGRPR

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-20240033320-A1 IMMUNORHELIN COMPOUNDS FOR INTRACELLULAR INFECTIONS ISR Immune System Regulation Holding AB (publ) (SE) 2024-02-01 — — US disclosed
US-20230118205-A1 NOVEL COMPOUNDS (IMMUNORHELINS) ISR IMMUNE SYSTEM REGULATION HOLDING AB PUBL (SE) 2023-04-20 — — US disclosed
US-11564969-B2 Immunorhelin compounds for intracellular infections ISR Immune System Regulation Holding AB (publ) (SE) 2023-01-31 — — US disclosed
US-11434258-B2 Compounds (immunorhelins) ISR Immune System Regulation Holding AB (SE) 2022-09-06 — — 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-20230118205-A1 NOVEL COMPOUNDS (IMMUNORHELINS) GNRHR, FSHR, LHCGR PTGS1 3702/4885GNRHR 1/4885ABCC2 4865/4885
US-20240033320-A1 IMMUNORHELIN COMPOUNDS FOR INTRACELLULAR INFECTIONS GNRHR, GHRHR, FSHR PTGS1 3887/4885GNRHR 1/4885ABCC2 4820/4885
US-11564969-B2 Immunorhelin compounds for intracellular infections GNRHR, GHRHR, FSHR PTGS1 3887/4885GNRHR 1/4885ABCC2 4820/4885
US-11434258-B2 Compounds (immunorhelins) GNRHR, FSHR, LHCGR PTGS1 3304/4885GNRHR 1/4885ABCC2 4867/4885

“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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