SCHEMBL6512254

SCHEMBL6512254

CC(C)C[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1ccc(O)cc1)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](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.71
▸ GNRHR P30968 2/20 0.65
▸ ABCC2 Q92887 1/20 0.64
▸ C5AR1 P21730 2/20 0.62
▸ APLNR P35414 5/20 0.58
▸ CXCR4 P61073 3/20 0.58

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
SCHEMBL30773556 1.00 PTGS1 (0.71) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL1652722 0.97 PTGS1 (0.74) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL22289009 0.97 PTGS1 (0.74) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL5079698 0.97 PTGS1 (0.74) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL1371630 0.97 PTGS1 (0.74) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL16815056 0.97 PTGS1 (0.74) PTGS1GNRHRABCC2C5AR1APLNR
SCHEMBL11678163 0.96 PTGS1 (0.73) PTGS1GNRHRABCC2C5AR1APLNR
SCHEMBL29425250 0.96 GNRHR (0.70) PTGS1GNRHRABCC2C5AR1APLNR
Triptorelin SCHEMBL29459903 0.96 PTGS1 (0.72) PTGS1GNRHRABCC2C5AR1APLNR
SCHEMBL29373920 0.96 PTGS1 (0.72) PTGS1GNRHRABCC2C5AR1CXCR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2024-03-21 — — US disclosed
US-11925689-B2 Multifunctional forms of polyoxazoline copolymers and drug compositions comprising the same SERINA THERAPEUTICS, INC. (US) 2024-03-12 — — US disclosed
CN-117462693-A XTEN conjugate compositions and methods of making the same 阿穆尼克斯运营公司 2024-01-30 — — CN disclosed
US-20230338575-A1 COBALT-DOPED IRON OXIDE NANOPARTICLES AND METHODS FOR MAKING AND USING OREGON STATE UNIVERSITY (US) 2023-10-26 — — US disclosed
CN-111971060-B Bifunctional molecules that recruit antibodies and target tumor cells 江南大学 2023-06-13 — — CN disclosed
US-20230060997-A1 RADIONUCLIDE-LHRH CONJUGATES FOR DIAGNOSIS OF REPRODUCTIVE CANCERS Eastern Kentucky University 2023-03-02 — — US disclosed
US-20220193243-A1 MULTIFUNCTIONAL FORMS OF POLYOXAZOLINE COPOLYMERS AND DRUG COMPOSITIONS COMPRISING THE SAME SERINA THERAPEUTICS, INC. (US) 2022-06-23 — — US disclosed
US-20210290787-A1 MACROCYCLE CONJUGATES LUMIPHORE, INC. 2021-09-23 — — US disclosed
US-20050004000-A1 Oral absorbed drugs YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2005-01-06 — — US disclosed
EP-1383538-A2 ORAL ABSORBED DRUGS YEDA RESEARCH AND DEVELOPMENT CO., Ltd. (IL) 2004-01-28 — — EP disclosed
WO-2002078597-A2 ORAL ABSORBED DRUGS YEDA RESEARCH AND DEVELOPMENT CO. LTD. WEIZMANN INSTITUTE OF SCIENCE (IL) 2002-10-10 — — WO disclosed
US-4338305-A LUTEINIZING HORMONE RELEASING HORMONE; CONTRACEPTIVES AMERICAN HOME PRODUCTS CORPORATION (US) 1982-07-06 — — 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 (7 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-20230060997-A1 RADIONUCLIDE-LHRH CONJUGATES FOR DIAGNOSIS OF REPRODUCTIVE CANCERS LHCGR, GNRHR, FSHR PTGS1 4748/4885GNRHR 2/4885ABCC2 4186/4885
US-20220193243-A1 MULTIFUNCTIONAL FORMS OF POLYOXAZOLINE COPOLYMERS AND DRUG COMPOSITIONS COMPRISING THE SAME ERBB3, ERBB2, PANK2 PTGS1 1852/4885GNRHR 3907/4885ABCC2 359/4885
US-20210290787-A1 MACROCYCLE CONJUGATES FOLH1, KLK3, CD47 PTGS1 3282/4885GNRHR 85/4885ABCC2 2911/4885
US-11925689-B2 Multifunctional forms of polyoxazoline copolymers and drug compositions comprising the same ERBB3, ERBB2, PANK2 PTGS1 1852/4885GNRHR 3907/4885ABCC2 359/4885
US-20230338575-A1 COBALT-DOPED IRON OXIDE NANOPARTICLES AND METHODS FOR MAKING AND USING FECH, CD63, ENO1 PTGS1 635/4885GNRHR 356/4885ABCC2 3418/4885
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 PTGS1 3385/4885GNRHR 937/4885ABCC2 1527/4885
US-20050004000-A1 Oral absorbed drugs TPMT, CYP2C9, SLCO2B1 PTGS1 1060/4885GNRHR 2250/4885ABCC2 337/4885

“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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