SCHEMBL20561252

SCHEMBL20561252

C[C@]1(C(=O)NC(=O)[C@@]2(C)CCC[C@]3(C)c4cc(OCc5ccccc5)ccc4CC[C@@H]23)CCC[C@]2(C)c3cc(NC(=O)O)ccc3CC[C@@H]12

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 14/20 0.59
▸ NR1H3 Q13133 14/20 0.59
▸ POLA1 P09884 2/20 0.55
▸ MMP3 P08254 3/20 0.49
▸ MMP9 P14780 3/20 0.49
▸ MMP8 P22894 3/20 0.49
▸ PTPN1 P18031 1/20 0.47

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
SCHEMBL6310538 0.94 NR1H2 (0.66) NR1H2NR1H3POLA1PTPN1
SCHEMBL20561122 0.94 NR1H2 (0.66) NR1H2NR1H3POLA1PTPN1
SCHEMBL20561169 0.91 NR1H2 (0.53) NR1H2NR1H3POLA1MMP3MMP9
SCHEMBL29493620 0.91 NR1H2 (0.53) NR1H2NR1H3POLA1MMP3MMP9
SCHEMBL20561211 0.89 NR1H2 (0.60) NR1H2NR1H3POLA1PTPN1
SCHEMBL31678792 0.89 NR1H2 (0.60) NR1H2NR1H3POLA1PTPN1
SCHEMBL20561213 0.88 NR1H2 (0.59) NR1H2NR1H3POLA1PTPN1
SCHEMBL6312190 0.87 POLA1 (0.72) NR1H2NR1H3POLA1PTPN1
SCHEMBL6309929 0.87 POLA1 (0.72) NR1H2NR1H3POLA1PTPN1
SCHEMBL6312187 0.87 POLA1 (0.72) NR1H2NR1H3POLA1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883926-B1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDE DERIVATIVES AND PROTEIN CONJUGATES THEREOF FOR USE AS LXR AGONISTS REGENERON PHARMA (US) 2024-07-10 — — EP disclosed
US-20230079407-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. 2023-03-16 — — US disclosed
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2023-02-02 — — US disclosed
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof REGENERON PHARMACEUTICALS, INC. (US) 2022-07-05 — — US disclosed
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2022-04-14 — — US disclosed
US-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2021-10-28 — — US disclosed
EP-3790899-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2021-03-17 — — EP disclosed
WO-2019217591-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2019-11-14 — — WO disclosed
US-20180333504-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES REGENERON PHAMACEUTICALS, INC. 2018-11-22 — — US disclosed
US-20180334426-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2018-11-22 — — 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-20210332080-A1 HYDROPHILIC LINKERS FOR ANTIBODY DRUG CONJUGATES CD44, CD47, EPCAM NR1H2 3175/4885NR1H3 2873/4885POLA1 3401/4885
US-20180334426-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR NR1H2 4/4885NR1H3 2/4885POLA1 2752/4885
US-20230079407-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF CD47, MSR1, LDLR NR1H2 195/4885NR1H3 128/4885POLA1 2693/4885
US-20180333504-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES SDCBP, DDOST, KRTCAP2 NR1H2 1304/4885NR1H3 1332/4885POLA1 4011/4885
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR NR1H2 4/4885NR1H3 2/4885POLA1 2752/4885
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES SDCBP, DDOST, KRTCAP2 NR1H2 1304/4885NR1H3 1332/4885POLA1 4011/4885
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof CD47, MSR1, LDLR NR1H2 195/4885NR1H3 128/4885POLA1 2693/4885

“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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