SCHEMBL6958797

SCHEMBL6958797

CCCNC1Cc2c([nH]c3ccc(C(=O)Nc4cn[nH]c4)cc23)C(OS(C)(=O)=O)C1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.38
DRD2 P14416 1/20 0.38
KDM1A O60341 1/20 0.37
MAOA P21397 1/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.35
MAPKAPK2 P49137 4/20 0.35
RPS6KA2 Q15349 2/20 0.35
NAMPT P43490 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 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
SCHEMBL6958794 0.83 HTR1A (0.48) HTR1ADRD2MEN1KMT2ARAB9A
SCHEMBL7971650 0.76 HTR1A (0.35) HTR1ADRD2MAPTTP53POLB
SCHEMBL8100872 0.73 HTR1A (0.35) HTR1ADRD2MAPTTP53MAPKAPK2
SCHEMBL6958771 0.65 HTR1A (0.50) HTR1ADRD2MAPTTP53MEN1
SCHEMBL8110438 0.65 ALDH1A1 (0.37) HTR1ADRD2MAPTMAPKAPK2MEN1
SCHEMBL9336316 0.65 HTR1A (0.58) HTR1ADRD2MAPTTP53MEN1
SCHEMBL6960098 0.64 ALDH1A1 (0.51) HTR1ADRD2MAPTMEN1KMT2A
SCHEMBL8114909 0.63 HTR1A (0.38) HTR1ADRD2MAPTTP53MEN1
Oxalic Acid SCHEMBL9334144 0.62 HTR1A (0.56) HTR1ADRD2MAPTTP53MEN1
SCHEMBL6965193 0.62 HTR1A (0.56) HTR1ADRD2MAPTMEN1KMT2A

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-0882726-B1 Carbazol-carboxamides as 5-HT1F agonists LILLY CO ELI (US) 2003-05-21 EP disclosed
US-6221884-B1 Carboxamides useful as 5-HT1F agonists ELI LILLY AND COMPANY 2001-04-24 US disclosed
WO-1998055115-A1 CARBOXAMIDES USEFUL AS 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 1998-12-10 WO disclosed
EP-0882726-A1 Carbazol-carboxamides as 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-12-09 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 HTR1A 2/4885DRD2 691/4885KDM1A 1567/4885

“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.