SCHEMBL4641409

SCHEMBL4641409

O=P(CO)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.64
HPGD P15428 1/20 0.50
CETP P11597 3/20 0.49
SRC P12931 1/20 0.45
PDPK1 O15530 1/20 0.44
MTOR P42345 1/20 0.44
ALPG P10696 1/20 0.44
PTK2B Q14289 1/20 0.44
ALDH1A1 P00352 3/20 0.44
FOLH1 Q04609 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL7341230 0.91 TSHR (0.55) TSHRHPGDCETPALDH1A1FOLH1
SCHEMBL7336647 0.84 TSHR (0.51) TSHRHPGDCETPALDH1A1FOLH1
SCHEMBL5028595 0.84 TSHR (0.60) TSHRHPGDCETPSRCPDPK1
SCHEMBL3367144 0.83 TSHR (0.64) TSHRHPGDCETPSRCPDPK1
SCHEMBL5327008 0.83 TSHR (0.63) TSHRCETPSRCPDPK1MTOR
SCHEMBL4154492 0.81 TSHR (0.56) TSHRHPGDCETPSRCPDPK1
SCHEMBL2469341 0.81 TSHR (0.56) TSHRHPGDCETPSRCPDPK1
SCHEMBL7520596 0.81 TSHR (0.67) TSHRHPGDCETPSRCPDPK1
SCHEMBL5850148 0.81 TSHR (0.61) TSHRHPGDCETPSRCPDPK1
SCHEMBL413304 0.80 TSHR (0.60) TSHRCETPSRCALDH1A1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260116913-A1 NEUROSTEROID COMPOUNDS AND METHODS FOR THEIR PREPARATION AND USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS TEXAS A & M UNIV SYS (US) 2026-04-30 US disclosed
US-12509487-B2 Neurosteroid compounds and methods for their preparation and use in treating central nervous system disorders THE TEXAS A&M UNIVERSITY SYSTEM (US) 2025-12-30 US disclosed
US-20250170156-A1 TOLL-LIKE RECEPTOR LIGANDS INIMMUNE CORP (US) 2025-05-29 US disclosed
US-12150948-B2 Toll-like receptor ligands NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT (US) 2024-11-26 US disclosed
EP-4410802-A2 TOLL-LIKE RECEPTOR LIGANDS INIMMUNE CORPORATION (US) 2024-08-07 EP disclosed
CN-111867623-B TOLL-like receptor ligands 英尼穆内公司 2024-06-04 CN disclosed
EP-3752182-B1 TOLL-LIKE RECEPTOR LIGANDS INIMMUNE CORP (US) 2024-05-15 EP disclosed
US-20230151052-A1 NEUROSTEROID COMPOUNDS AND METHODS FOR THEIR PREPARATION AND USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS THE TEXAS A&M UNIVERSITY SYSTEM 2023-05-18 US disclosed
US-20230151052-A1 NEUROSTEROID COMPOUNDS AND METHODS FOR THEIR PREPARATION AND USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS THE TEXAS A&M UNIVERSITY SYSTEM 2023-05-18 US disclosed
US-20230055805-A1 TOLL-LIKE RECEPTOR LIGANDS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-02-23 US disclosed
WO-2007050732-A1 INDAZOLE DERIVATIVES THAT INHIBIT TRPVl RECEPTOR ABBOTT LABORATORIES (US) 2007-05-03 WO disclosed
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds GILEAD SCIENCES, INC. 2007-01-11 US disclosed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO disclosed
WO-2001055082-A2 INTERMEDIATES FOR BIOLOGICALLY ACTIVE COMPOUNDS ROHM AND HAAS COMPANY (US) 2001-08-02 WO disclosed
EP-0691985-B1 PHOSPHONOMETHYLDIPEPTIDES MERRELL PHARMA INC (US) 2000-05-03 EP disclosed
US-5952327-A NEUTRAL ENDOPEPTIDASE INHIBITORS; TREATMENT OF CARDIOVASCULAR DISORDERS SOLVAY PHARMACEUTICALS GMBH (DE) 1999-09-14 US disclosed
US-5608078-A Phosphonomethyldipeptides and process for preparation thereof MERRELL PHARMACEUTICALS INC. (US) 1997-03-04 US disclosed
EP-0691985-A1 PHOSPHONOMETHYLDIPEPTIDES MERRELL PHARMACEUTICALS INC. (US) 1996-01-17 EP disclosed
WO-1994022908-A1 PHOSPHONOMETHYLDIPEPTIDES MERRELL DOW PHARMACEUTICALS INC. (US) 1994-10-13 WO disclosed
EP-0618224-A1 Phosphonomethyldipeptides MERRELL DOW PHARMACEUTICALS INC. (US) 1994-10-05 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 (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-20230151052-A1 NEUROSTEROID COMPOUNDS AND METHODS FOR THEIR PREPARATION AND USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS CYP11B2, CYP21A2, CYP11B1 TSHR 1213/4885HPGD 60/4885CETP 972/4885
US-20230055805-A1 TOLL-LIKE RECEPTOR LIGANDS TLR1, TLR4, TLR6 TSHR 1009/4885HPGD 3219/4885CETP 846/4885
US-12509487-B2 Neurosteroid compounds and methods for their preparation and use in treating central nervous system disorders SLC6A11, GABRE, SLC6A13 TSHR 2032/4885HPGD 344/4885CETP 2436/4885
US-12150948-B2 Toll-like receptor ligands TLR1, TLR4, TLR6 TSHR 1009/4885HPGD 3219/4885CETP 846/4885
US-20260116913-A1 NEUROSTEROID COMPOUNDS AND METHODS FOR THEIR PREPARATION AND USE IN TREATING CENTRAL NERVOUS SYSTEM DISORDERS CHRNA9, HSD3B2, HSD3B1 TSHR 223/4885HPGD 482/4885CETP 1915/4885
US-20250170156-A1 TOLL-LIKE RECEPTOR LIGANDS TLR1, TLR4, TLR6 TSHR 1009/4885HPGD 3219/4885CETP 846/4885
US-20070010489-A1 Cellular accumulation of phosphonate analogs of hiv protease inhibitor compounds PPA1, PNP, PPME1 TSHR 4782/4885HPGD 1843/4885CETP 2347/4885

“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.