SCHEMBL21711299

SCHEMBL21711299

CN(C)C(=O)c1ncn(C(=O)N(C)N)c1N

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAP4K1 Q92918 1/20 0.33
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6304343 0.85 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2
SCHEMBL21711302 0.85 LMNA (0.36) ALDH1A1LMNASMN1; SMN2
SCHEMBL21711289 0.85 ALDH1A1 (0.36) ALDH1A1LMNASMN1; SMN2
SCHEMBL22847418 0.81 ALDH1A1 (0.33) ALDH1A1LMNA
SCHEMBL21675343 0.81 ALDH1A1 (0.34) ALDH1A1LMNASMN1; SMN2
SCHEMBL13629004 0.78 SMN1; SMN2 (0.33) ALDH1A1LMNASMN1; SMN2
SCHEMBL24230401 0.73 RIPK1 (0.38) ALDH1A1LMNASMN1; SMN2
SCHEMBL20648760 0.70 KMT2A (0.46) ALDH1A1SMN1; SMN2
SCHEMBL24230262 0.69 CD38 (0.35)
SCHEMBL21711286 0.69 MAPK14 (0.40) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020033880-A1 IMIDAZOTETRAZINE COMPOUNDS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2020-02-13 WO disclosed