SCHEMBL8723639

SCHEMBL8723639

CCCOCCC(=O)Nc1ccc2scc(C3CCC4CCCCN4CC3)c2c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HTR1D P28221 9/20 0.39
HTR1B P28222 9/20 0.39
HRH3 Q9Y5N1 6/20 0.37
MCHR1 Q99705 3/20 0.36
KCNH2 Q12809 1/20 0.36
DRD2 P14416 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL8721866 0.89 TP53 (0.38) KDM4EALDH1A1MAPTHTR1DHTR1B
SCHEMBL8725933 0.86 HTR1D (0.45) ALDH1A1HTR1DHTR1BHRH3
SCHEMBL8551288 0.84 HTR1D (0.40) KDM4EMAPTHTR1DHTR1BHRH3
SCHEMBL8721868 0.83 HRH3 (0.34) KDM4EALDH1A1MAPTHTR1DHTR1B
SCHEMBL8721056 0.83 MCHR1 (0.38) MAPTHRH3MCHR1KCNH2
SCHEMBL8721062 0.83 LMNA (0.43) HTR1DHTR1BHRH3
SCHEMBL8720655 0.82 PNLIP (0.41) DRD2SLC6A4
SCHEMBL30909140 0.82 PNLIP (0.41) DRD2SLC6A4
SCHEMBL8722156 0.81 DRD2 (0.38) KDM4EALDH1A1MAPTHTR1DHTR1B
SCHEMBL8720761 0.81 TPSAB1 (0.43) MAPTHTR1DHTR1B

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 3 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-0875513-A1 Substituted heteroaromatic 5-HT 1F agonists ELI LILLY AND COMPANY (US) 1998-11-04 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 KDM4E 3551/4885ALDH1A1 563/4885MAPT 3544/4885

“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.