SCHEMBL295296

SCHEMBL295296

Nc1nnc(C2CCCCC2)s1

nearest known ligand 0.96

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.46
POLB P06746 2/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 9/20 0.42
HPGD P15428 3/20 0.40
GFER P55789 2/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
HSD17B10 Q99714 2/20 0.39
MAPK1 P28482 1/20 0.39
TSHR P16473 1/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL11669798 1.00 GAA (0.46) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL2535265 0.98 SMN1; SMN2 (0.47) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL11554100 0.93 ALDH1A1 (0.46) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL295263 0.89
SCHEMBL16879368 0.89 SMN1; SMN2 (0.41) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL15710144 0.85 ALDH1A1 (0.43) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL15709601 0.85 ALDH1A1 (0.43) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL15743173 0.85 ALDH1A1 (0.43) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL15709843 0.85 ALDH1A1 (0.43) GAAPOLBSMN1; SMN2ALDH1A1HPGD
SCHEMBL15725217 0.80 SMN1; SMN2 (0.38) GAAPOLBSMN1; SMN2ALDH1A1HPGD

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 89 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658072-A4 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PROD INC (US) 2009-03-25 EP claimed
US-20070270426-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER INC. 2007-11-22 US claimed
US-7253195-B2 Compounds for the treatment of neurodegenerative disorders PFIZER INC (US) 2007-08-07 US claimed
EP-1658072-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS Pfizer Products Inc. (US) 2006-05-24 EP claimed
WO-2005020991-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS PFIZER PRODUCTS, INC. (US) 2005-03-10 WO claimed
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders PFIZER, INC. (US) 2005-02-24 US claimed
US-20240368173-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2024-11-07 US disclosed
EP-4419203-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2024-08-28 EP disclosed
CN-118451080-A Tricyclic GPR65 modulators 帕蒂奥斯治疗有限公司 2024-08-06 CN disclosed
WO-2023067322-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2023-04-27 WO disclosed
WO-2023067322-A1 TRICYCLIC GPR65 MODULATORS Pathios Therapeutics Limited (GB) 2023-04-27 WO disclosed
WO-2023067515-A1 THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2023-04-27 WO disclosed
WO-2023067515-A1 THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2023-04-27 WO disclosed
US-4007031-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1977-02-08 US disclosed
US-4004912-A 1-Thiadiazolyl-6-acyloxytetrahydropyrimidinone herbicides VELSICOL CHEMICAL CORPORATION (US) 1977-01-25 US disclosed
US-3990882-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-11-09 US disclosed
US-3951640-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-04-20 US disclosed
US-3944409-A Method of increasing the yield of plants having storage organs by treatment with thiadiazolylimidazolines VELSICOL CHEMICAL CORPORATION (US) 1976-03-16 US disclosed
US-3933839-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-01-20 US disclosed
US-3931209-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-01-06 US 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 (3 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-20240368173-A1 TRICYCLIC GPR65 MODULATORS GPR65, GPR3, NR1H2 GAA 4385/4885POLB 4152/4885SMN1; SMN2 4744/4885
US-20070270426-A1 COMPOUNDS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS APP, BACE1, PSEN1 GAA 131/4885POLB 3697/4885SMN1; SMN2 47/4885
US-20050043372-A1 Compounds for the treatment of neurodegenerative disorders APP, BACE1, PSEN1 GAA 131/4885POLB 3697/4885SMN1; SMN2 47/4885

“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.