SCHEMBL24197399

SCHEMBL24197399

CNCCNCc1ccnc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.50
▸ HTR1A P08908 2/20 0.47
▸ ADRA1D P25100 2/20 0.47
▸ ADRA1A P35348 2/20 0.47
▸ ADRA1B P35368 2/20 0.47
▸ MOK Q9UQ07 1/20 0.45
▸ FERMT2 Q96AC1 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ NCF1 P14598 1/20 0.41
▸ SLC2A1 P11166 1/20 0.40
▸ PDE10A Q9Y233 1/20 0.40
▸ MAOA P21397 1/20 0.40
▸ MAOB P27338 1/20 0.40
▸ PDCD1 Q15116 1/20 0.39
▸ CD274 Q9NZQ7 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL1253989 0.84 LOXL2 (0.58) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL3265308 0.83 LOXL2 (0.49) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL19563549 0.82 HTR1A (0.53) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL1040581 0.81 LOXL2 (0.55) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL16418000 0.81 LOXL2 (0.55) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL30331546 0.81 GAA (0.50) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL24197400 0.81 GAA (0.50) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL15826444 0.80 S1PR2 (0.52) LOXL2HTR1AADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL17260150 0.79 SLC2A1 (0.52) LOXL2HTR1AADRA1DADRA1AADRA1B
SCHEMBL6155906 0.78 LOXL2 (0.55) LOXL2HTR1AADRA1DADRA1AADRA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346769-A1 USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS LEISHMANIA UNIVERSIDAD DE GRANADA (ES) 2023-11-02 — — US disclosed
US-20230346769-A1 USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS LEISHMANIA UNIVERSIDAD DE GRANADA (ES) 2023-11-02 — — US disclosed
EP-4180039-A1 <SMALLCAPS/>? ? ?LEISHMANIA? ? ? ? ?USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS Universidad de Granada (ES) 2023-05-17 — — EP disclosed
EP-4180039-A1 <SMALLCAPS/>? ? ?LEISHMANIA? ? ? ? ?USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS Universidad de Granada (ES) 2023-05-17 — — EP disclosed
WO-2022008784-A1 USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS LEISHMANIA UNIVERSIDAD DE GRANADA (ES) 2022-01-13 — — WO 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-20230346769-A1 USE OF SIMPLE ACYCLIC POLYAMINES FOR THE TREATMENT OF DISEASES CAUSED BY PARASITES OF THE GENUS LEISHMANIA SRM, SMS, ARG2 LOXL2 1254/4885HTR1A 3949/4885ADRA1D 2711/4885

“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.

Send feedback