SCHEMBL8101211

SCHEMBL8101211

CCCCOC(=O)CC(=O)Nc1ccc2[nH]c3c(c2c1)CC(CNCCc1cnn(C(C)C)c1)CC3

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VPS4B O75351 1/20 0.37
VCP P55072 1/20 0.37
HTR1D P28221 2/20 0.37
HTR1B P28222 2/20 0.37
HTR1F P30939 1/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
RORC P51449 1/20 0.33
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
FLT4 P35916 2/20 0.32
KDR P35968 2/20 0.32
EGFR P00533 1/20 0.32
IGF1R P08069 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL8116970 0.90 HTR1D (0.39) HTR1DHTR1BHTR1FALDH1A1LMNA
SCHEMBL8109143 0.83 VPS4B (0.36) VPS4BVCPHTR1DHTR1BHTR1F
SCHEMBL8109141 0.80 KMT2A (0.38) VPS4BVCPHTR1FALDH1A1RORC
SCHEMBL30908994 0.80 VPS4B (0.42) VPS4BVCPHTR1FALDH1A1RORC
SCHEMBL8101509 0.80 VPS4B (0.42) VPS4BVCPHTR1FALDH1A1RORC
Glycolic Acid SCHEMBL30908912 0.78 VPS4B (0.37) VPS4BVCPHTR1FALDH1A1RORC
SCHEMBL8109281 0.77 VPS4B (0.41) VPS4BVCPHTR1DHTR1BHTR1F
Hydrochloric Acid SCHEMBL8110488 0.75 VPS4B (0.46) VPS4BVCPHTR1DHTR1BHTR1F
SCHEMBL8110196 0.74 HTR1F (0.34) HTR1DHTR1BHTR1FALDH1A1LMNA
Hexanoate SCHEMBL8110191 0.73 HTR1A (0.39) HTR1DHTR1BHTR1FALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260125645-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ LP (CA) 2026-05-07 US disclosed
WO-2024073845-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS VALORISATION HSJ, LIMITED PARTNERSHIP (CA) 2024-04-11 WO disclosed
EP-0749962-B1 6-substituted-1,2,3,4-tetrahydro-9H-carbazoles and 7-substituted-10H-cyclohepta(7,6-B)indoles LILLY CO ELI (US) 2000-11-02 EP disclosed
US-5814653-A SUMATRIPTAN FOR RELIEF OF MIGRAINE PAIN AND OTHER DISORDERS ASSOCIATED WITH PEPTIDE EXTRAVASATION DIE TO STUMULATION OF THE TRIGEMINAL GANGLIA; 5-HT 1F AGONISTS ELI LILLY AND COMPANY (US) 1998-09-29 US disclosed
US-5708187-A MIGRANE HEADACHES ELI LILLY AND COMPANY (US) 1998-01-13 US disclosed
EP-0749962-A1 6-substituted-1,2,3,4-tetrahydro-9H-carbazoles and 7-substituted-10H-cyclohepta(7,6-B)indoles ELI LILLY AND COMPANY (US) 1996-12-27 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-20260125645-A1 METHODS AND PHARMACOLOGICAL AGENTS FOR INCREASING EXPANSION, ENGRAFTMENT OR IMMUNE OUTPUT OF HUMAN HEMATOPOIETIC STEM CELLS IN TRANSPLANTATION AND DISEASE SETTINGS HTR1F, HTR1A, HTR1D VPS4B 2551/4885VCP 2902/4885HTR1D 3/4885

“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.