SCHEMBL5497592

SCHEMBL5497592

C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2C(=O)C(O)O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SERPINA6 P08185 4/20 0.80
▸ FNTA P49354 1/20 0.69
▸ FNTB P49356 1/20 0.69
▸ SMN1; SMN2 Q16637 8/20 0.58
▸ LMNA P02545 5/20 0.58
▸ POLB P06746 1/20 0.58
▸ CYP3A4 P08684 5/20 0.58
▸ ALDH1A1 P00352 5/20 0.58
▸ MAPT P10636 4/20 0.58
▸ TSHR P16473 3/20 0.58
▸ MAPK1 P28482 3/20 0.58
▸ SHBG P04278 3/20 0.58
▸ CYP2C9 P11712 2/20 0.58
▸ HIF1A Q16665 2/20 0.58
▸ NR3C2 P08235 2/20 0.58
▸ NR3C1 P04150 2/20 0.58
▸ PMP22 Q01453 2/20 0.58
▸ ABCB11 O95342 2/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ CYP2C19 P33261 1/20 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
SCHEMBL15904593 0.89 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL14525642 0.89 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL14420894 0.89 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL668966 0.89 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL15920543 0.89 SERPINA6 (1.00) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL9348241 0.88 SERPINA6 (0.85) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL9348234 0.88 SERPINA6 (0.85) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL18927106 0.88 SERPINA6 (0.85) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL6347180 0.87 SERPINA6 (0.84) SERPINA6FNTAFNTBSMN1; SMN2LMNA
SCHEMBL31095098 0.86 SERPINA6 (0.82) SERPINA6FNTAFNTBSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115725522-A Steroid hormone dehydrogenase, gene, mutant, construction method and application 湖南新合新生物医药有限公司 2023-03-03 — — CN claimed
CN-113528474-B 3-sterone-delta1Dehydrogenase and coding gene and application thereof 中国科学院天津工业生物技术研究所 2021-12-10 — — CN claimed
CN-111349677-B Biocatalysis preparation method of steroid C1, 2-position dehydrogenation drug intermediate 中国科学院天津工业生物技术研究所 2021-11-12 — — CN claimed
CN-113528474-A 3-sterone-delta1Dehydrogenase and coding gene and application thereof 中国科学院天津工业生物技术研究所 2021-10-22 — — CN claimed
CN-111349677-A Biocatalysis preparation method of steroid C1, 2-position dehydrogenation drug intermediate 中国科学院天津工业生物技术研究所 2020-06-30 — — CN claimed
CN-115725522-A Steroid hormone dehydrogenase, gene, mutant, construction method and application 湖南新合新生物医药有限公司 2023-03-03 — — CN disclosed
CN-113528474-B 3-sterone-delta1Dehydrogenase and coding gene and application thereof 中国科学院天津工业生物技术研究所 2021-12-10 — — CN disclosed
CN-111349677-B Biocatalysis preparation method of steroid C1, 2-position dehydrogenation drug intermediate 中国科学院天津工业生物技术研究所 2021-11-12 — — CN disclosed
CN-113528474-A 3-sterone-delta1Dehydrogenase and coding gene and application thereof 中国科学院天津工业生物技术研究所 2021-10-22 — — CN disclosed
CN-113493484-A Preparation method of methylprednisolone and intermediate thereof 河南利华制药有限公司 2021-10-12 — — CN disclosed
CN-113423827-A Biotechnological optimization of microorganisms for 1, 2-dehydrogenation of steroids 赛诺菲 2021-09-21 — — CN disclosed
CN-111349677-A Biocatalysis preparation method of steroid C1, 2-position dehydrogenation drug intermediate 中国科学院天津工业生物技术研究所 2020-06-30 — — CN disclosed
CN-110612122-A Methods and compositions related to combination therapy with anti-inflammatory agents and synthetic nanocarriers comprising immunosuppressants 西莱克塔生物科技公司 2019-12-24 — — CN disclosed
US-20070129282-A1 Pharmaceutical treatments and compositions BIOVIE INC. 2007-06-07 — — US disclosed
US-5001116-A Inhibition of angiogenesis THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 1991-03-19 — — US disclosed
EP-0088462-A2 Anti-inflammatory and rheumatic composition containing organophosphonate and steroid THE PROCTER & GAMBLE COMPANY (US) 1983-09-14 — — EP 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-20070129282-A1 Pharmaceutical treatments and compositions HSD3B1, HSD3B2, HSD17B1 SERPINA6 87/4885FNTA 382/4885FNTB 921/4885

“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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