SCHEMBL6985595

SCHEMBL6985595

Cc1csc(N=C(N)N)n1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
GFER P55789 1/20 0.57
ATP4A P20648 17/20 0.54
ATP4B P51164 17/20 0.54
NPSR1 Q6W5P4 1/20 0.51

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
Hydrochloric Acid SCHEMBL6989280 0.98 MAPT (0.56) MAPTNPC1RAB9AGFERATP4A
Bromide SCHEMBL826907 0.72 MAPT (0.97) MAPTNPC1RAB9AGFERATP4A
SCHEMBL5879530 0.72 CYP1A2 (0.50) MAPTNPC1RAB9AGFERATP4A
SCHEMBL2359189 0.72 RAB9A (0.46) NPC1RAB9AATP4AATP4B
SCHEMBL15109249 0.71
Zaltidine SCHEMBL4606700 0.71 ATP4A (0.63) MAPTNPC1RAB9AGFERATP4A
SCHEMBL22296554 0.71 HRH2 (0.53) MAPTNPC1RAB9AGFERATP4A
SCHEMBL10776417 0.71 SLC22A2 (0.50) MAPTNPC1RAB9AGFERATP4A
SCHEMBL8708729 0.71 CYP1A2 (0.49) MAPTNPC1RAB9AGFERATP4A
SCHEMBL7143536 0.70 RAB9A (0.60) MAPTNPC1RAB9AGFERATP4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220125732-A1 IBUPROFEN AND FAMOTIDINE TABLET APPCO PHARMA LLC (US) 2022-04-28 US disclosed
EP-3728211-A1 BIGUANIDE DERIVATIVES AND THEIR REARRANGEMENT PRODUCTS FOR USE IN THE TREATMENT OF CANCER Centre National de la Recherche Scientifique (FR) 2020-10-28 EP disclosed
EP-0920314-B1 NON-PEPTIDE G-CSF MIMETICS SMITHKLINE BEECHAM CORP (US) 2003-08-27 EP disclosed
EP-0920314-A4 NON-PEPTIDE G-CSF MIMETICS SMITHKLINE BEECHAM CORP (US) 2001-08-16 EP disclosed
US-5981551-A GRANULOCYTE COLONY-STIMULATING FACTOR MIMETICS; TREATMENT OF NEUTROPENIA SMITHKLINE BEECHAM CORPORATION (US) 1999-11-09 US disclosed
EP-0920314-A1 NON-PEPTIDE G-CSF MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 1999-06-09 EP disclosed
WO-1997044033-A1 NON-PEPTIDE G-CSF MIMETICS SMITHKLINE BEECHAM CORPORATION (US) 1997-11-27 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-20220125732-A1 IBUPROFEN AND FAMOTIDINE TABLET KIT, PTGER4, GSDMD MAPT 1727/4885NPC1 3085/4885RAB9A 3330/4885

“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.