SCHEMBL23399370

SCHEMBL23399370

CCn1nc(C)c(C(C)(C)C)c1O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.37
ADORA2B P29275 2/20 0.37
LMNA P02545 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPT P10636 1/20 0.30

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
SCHEMBL23398466 0.85 ADORA2A (0.41) ADORA2AADORA2B
SCHEMBL23402396 0.82 CNR1 (0.35) ADORA2AADORA2B
SCHEMBL23401316 0.80
SCHEMBL23399969 0.79 SMN1; SMN2 (0.39)
SCHEMBL12251595 0.79 ADORA2A (0.39) ADORA2AADORA2BLMNAALOX15MAPT
SCHEMBL23400263 0.78
SCHEMBL23402197 0.76 ADORA2A (0.37) ADORA2AADORA2BLMNAALOX15
SCHEMBL12732051 0.76 ADORA2A (0.37) ADORA2AADORA2B
SCHEMBL23399245 0.76
SCHEMBL23399365 0.76

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-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-03-09 US disclosed
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed
US-20170001996-A1 GLS1 INHIBITORS FOR TREATING DISEASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2017-01-05 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 (2 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-20170001996-A1 GLS1 INHIBITORS FOR TREATING DISEASE GLS2, GLS, GLG1 ADORA2A 3133/4885ADORA2B 3962/4885LMNA 3276/4885
US-20230075221-A1 SUBSTITUTED 1,2,4-TRIAZOLO[4,3-A]PYRIDINE DERIVATIVE AND PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF TH, CYP4X1, CYP4B1 ADORA2A 2623/4885ADORA2B 2706/4885LMNA 3067/4885

“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.