SCHEMBL4911523

SCHEMBL4911523

CCOC(=O)C1CCCCO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
RAB9A P51151 1/20 0.46
ALDH1A1 P00352 7/20 0.43
KDM4E B2RXH2 5/20 0.43
TSHR P16473 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HSD17B10 Q99714 2/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 2/20 0.41
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL30289815 1.00 HPGD (0.46) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL8627456 0.94 HPGD (0.50) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL1813924 0.94 HPGD (0.50) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL8626242 0.94 HPGD (0.50) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL19565576 0.88
SCHEMBL19565577 0.88
SCHEMBL4914627 0.88
SCHEMBL16327961 0.81 CYP1A2 (0.38) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL30232114 0.80 HPGD (0.37) HPGDNPC1TP53CYP1A2CYP2C9
SCHEMBL17361182 0.80 ALDH1A1 (0.52) HPGDNPC1TP53CYP1A2CYP2C9

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
CN-116322696-A Heterocyclic compounds as receptor 2-triggering agonists expressed on myeloid cells and methods of use 安进公司 2023-06-23 CN disclosed
CN-115896065-A Stereoselective carboxylesterase, encoding gene, vector and application thereof 江南大学 2023-04-04 CN disclosed
CN-112898309-A Tricyclic compounds as immunomodulators 正大天晴药业集团股份有限公司 2021-06-04 CN disclosed
CN-108884103-B Tricyclic compounds as immunomodulators 正大天晴药业集团股份有限公司 2021-01-15 CN disclosed
CN-110121497-A Amidine catalyst for curable compositions SIKA技术股份公司 2019-08-13 CN disclosed
US-7465817-B2 Inositolized phospholipids CHARITE-UNIVERSITATS MEDIZIN BERLIN (DE) 2008-12-16 US disclosed
US-20080227763-A1 Administering hormone replacement therapy by applying a gel of Nomegestrol or Nomegestrol acetate to the skin; restoring genital bleeding in menopausal women LABORATOIRE THERAMEX 2008-09-18 US disclosed
EP-1562609-B1 INOSITOLIZED PHOSPHOLIPIDS CHARITE UNIVERSITAETSMEDIZIN (DE) 2006-10-25 EP disclosed
US-20060105996-A1 Inositolized phospholipids CHARITE-UNIVERSITATS MEDIZIN BERLIN (DE) 2006-05-18 US disclosed
EP-1615899-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACIDS AS PPAR MODULATORS PFIZER INC. (US) 2006-01-18 EP disclosed
WO-2004092145-A1 ALPHA SUBSTITUTED CARBOXYLIC ACID AS PPAR MODULATORS PFIZER INC. (US) 2004-10-28 WO disclosed
CN-1161102-C Systemic topical hormone compositions ̩��÷˹ʵ���� 2004-08-11 CN disclosed
WO-2004045623-A1 INOSITOLIZED PHOSPHOLIPIDS CHARITÉ-UNIVERSITÄTS MEDIZIN BERLIN (DE) 2004-06-03 WO disclosed
EP-1421941-A1 Phospholipid derivatives having a polyhydroxylated aliphatic carbocycle Reutter, Werner, Prof. Dr. (DE) 2004-05-26 EP disclosed
CN-1301146-A Topical hormonal composition with systemic effect THERAMEX (MC) 2001-06-27 CN disclosed
US-6087509-A DERIVATIVES OF TRIFLUOROBENZONITRILES HOECHST MARION ROUSSEL (FR) 2000-07-11 US disclosed
US-5750553-A ANTIANDROGENIC AGENTS ROUSSEL UCLAF (FR) 1998-05-12 US disclosed
US-5399590-A Treatment of skin tumors, rheumatic diseases GASTAUD JEAN M (FR) 1995-03-21 US disclosed
CN-1024013-C Cationic complexes of technetium-99 m AMERSHAM INTERNATION PLC (GB) 1994-03-16 CN disclosed
CN-1042543-A The cationic complex of technetium-99m AMERSHAM INTERNATION PLC (GB) 1990-05-30 CN 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-20060105996-A1 Inositolized phospholipids PHOSPHO1, SGMS1, CDIPT HPGD 1416/4885NPC1 196/4885TP53 4131/4885

“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.