SCHEMBL5538535

SCHEMBL5538535

CCCC(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 13/20 0.92
▸ PGR P06401 4/20 0.92
▸ CYP3A4 P08684 4/20 0.92
▸ USP2 O75604 3/20 0.92
▸ MEN1 O00255 1/20 0.92
▸ KMT2A Q03164 1/20 0.92
▸ MMP1 P03956 10/20 0.80
▸ LMNA P02545 2/20 0.76
▸ NR1I2 O75469 2/20 0.76
▸ MAPT P10636 2/20 0.76
▸ MLNR O43193 1/20 0.76
▸ ABCB11 O95342 1/20 0.76
▸ CYP3A5 P20815 1/20 0.76
▸ PPARG P37231 1/20 0.76
▸ SMN1; SMN2 Q16637 1/20 0.76
▸ NPSR1 Q6W5P4 1/20 0.76
▸ CYP2D6 P10635 1/20 0.76
▸ CYP2C9 P11712 1/20 0.76
▸ ADORA3 P0DMS8 1/20 0.75
▸ DRD2 P14416 1/20 0.75

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
SCHEMBL1943651 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
SCHEMBL11878162 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
SCHEMBL11858145 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
SCHEMBL11878158 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
SCHEMBL11852760 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
SCHEMBL11852753 1.00 NR3C1 (0.92) NR3C1PGRCYP3A4USP2MEN1
Betamethasone Valerate SCHEMBL7564753 0.96 NR3C1 (1.00) NR3C1PGRCYP3A4USP2MEN1
Betamethasone Valerate SCHEMBL14339612 0.96 NR3C1 (1.00) NR3C1PGRCYP3A4USP2MEN1
Betamethasone Valerate SCHEMBL9768470 0.96 NR3C1 (1.00) NR3C1PGRCYP3A4USP2MEN1
Betamethasone Valerate SCHEMBL14339607 0.96 NR3C1 (1.00) NR3C1PGRCYP3A4USP2MEN1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230210868-A1 Methods of Treatment Using ICAM-Modulating Agents AVM BIOTECHNOLOGY, LLC (US) 2023-07-06 — — US claimed
CN-118302171-A Lymphocyte populations and methods for producing the same AVM生物技术有限责任公司 2024-07-05 — — CN disclosed
JP-2023108567-A Method for producing steroid 17α,21-diesters 同仁医薬化工株式会社 2023-08-04 — — JP disclosed
US-20230210868-A1 Methods of Treatment Using ICAM-Modulating Agents AVM BIOTECHNOLOGY, LLC (US) 2023-07-06 — — US disclosed
US-20230172950-A1 Glucocorticoid Receptor (GR) Modulators for Treating a SARS-COV-2 Virus AVM BIOTECHNOLOGY, LLC (US) 2023-06-08 — — US disclosed
CN-116096421-A Methods for treating remission-type multiple sclerosis 渤健马萨诸塞州股份有限公司 2023-05-09 — — CN disclosed
US-20230096897-A1 Lymphocyte Population and Methods for Producing Same AVM BIOTECHNOLOGY, LLC (US) 2023-03-30 — — US disclosed
WO-2023034377-A1 LYMPHOCYTE POPULATION AND METHODS FOR PRODUCING SAME AVM BIOTECHNOLOGY, LLC (US) 2023-03-09 — — WO disclosed
EP-4142736-A1 GLUCOCORTICOID RECEPTOR (GR) MODULATORS FOR TREATING A SARS-COV-2 VIRUS AVM Biotechnology, LLC (US) 2023-03-08 — — EP disclosed
CN-115666583-A Glucocorticoid Receptor (GR) modulators for the treatment of SARS-COV-2 virus AVM生物技术有限责任公司 2023-01-31 — — CN disclosed
US-7250546-B2 Adhesive preparations HISAMITSU PHARMACEUTICALS CO., INC. (JP) 2007-07-31 — — US disclosed
US-20070083139-A1 Adhesive preparations HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2007-04-12 — — US disclosed
EP-1238664-B1 ADHESIVE PREPARATIONS HISAMITSU PHARMACEUTICAL CO (JP) 2007-02-14 — — EP disclosed
US-6835724-B2 Topical antiinflammatory agents for treating inflammatory dermatoses AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-28 — — US disclosed
US-20030109819-A1 Adhesive preparations HISAMITSU PHARMACEUTICAL CO., INC. (JP) 2003-06-12 — — US disclosed
EP-1238664-A1 ADHESIVE PREPARATIONS HISAMITSU PHARMACEUTICAL CO. INC. (JP) 2002-09-11 — — EP disclosed
US-20020103392-A1 CORTICOID-17,21-DICARBOXYLIC ESTERS AND CORTICOSTEROID 17-CARBOXYLIC ESTER 21-CARBONIC ESTERS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THESE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-08-01 — — US disclosed
EP-0393658-B1 Novel steroid derivatives SS PHARMACEUTICAL CO (JP) 1995-03-22 — — EP disclosed
EP-0393658-A2 Novel steroid derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1990-10-24 — — EP disclosed
US-4655971-A USING AN ANHYDRIDE AND ACID CATALYST TO ESTERIFY HYDROXY'S IN THE 17- OR 17- AND 21-POSITION; ENHANCED ANTIINFLAMMATORY AGENTS PLURICHEMIE ANSTALT (LI) 1987-04-07 — — 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 (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-20020103392-A1 CORTICOID-17,21-DICARBOXYLIC ESTERS AND CORTICOSTEROID 17-CARBOXYLIC ESTER 21-CARBONIC ESTERS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THESE COMPOUNDS NR3C1, HSD3B1, HSD17B7 NR3C1 1/4885PGR 707/4885CYP3A4 246/4885

“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.

Send feedback