SCHEMBL8720776

SCHEMBL8720776

O=C(Nc1ccc2scc(C3CCC4CCCCN4CC3)c2c1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.47
TRPV1 Q8NER1 4/20 0.44
MCHR1 Q99705 3/20 0.44
MCHR2 Q969V1 1/20 0.42
TRPV4 Q9HBA0 1/20 0.40
EPHX2 P34913 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HTR1D P28221 2/20 0.39
HTR1A P08908 1/20 0.39
HTR1B P28222 1/20 0.39
HTR1F P30939 1/20 0.39
NAMPT P43490 1/20 0.39
ABL1 P00519 3/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL8723856 0.88 HTR1D (0.50) HRH3NPC1RAB9AHTR1DHTR1A
SCHEMBL8725928 0.86 RORC (0.47) HRH3NPC1RAB9AHTR1DHTR1A
SCHEMBL8720774 0.86 L3MBTL3 (0.43) HRH3RAB9AHTR1DHTR1AHTR1B
Fumaric Acid SCHEMBL8725918 0.84 HTR1D (0.46) HRH3HTR1DHTR1AHTR1BHTR1F
Fumaric Acid SCHEMBL8725912 0.84 HTR1D (0.46) HRH3HTR1DHTR1AHTR1BHTR1F
SCHEMBL8551434 0.83 EPHX2 (0.48) HRH3TRPV1MCHR1EPHX2NPC1
SCHEMBL8724094 0.83 ACKR3 (0.39) HRH3NPC1RAB9AHTR1DHTR1A
SCHEMBL8721836 0.82 TMIGD3 (0.41) HRH3RAB9AHTR1DHTR1AHTR1B
SCHEMBL8721858 0.82 MAPT (0.42) HRH3TRPV1MCHR1NPC1RAB9A
SCHEMBL8723979 0.81 MAPT (0.41) HRH3TRPV4HTR1DHTR1AHTR1B

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 HRH3 126/4885TRPV1 593/4885MCHR1 28/4885

“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.