SCHEMBL28312583

SCHEMBL28312583

CC1NCNC1Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.41
▸ GBA1 P04062 1/20 0.40
▸ TP53 P04637 1/20 0.38

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
SCHEMBL28875477 0.76 POLB (0.40) POLBGBA1
SCHEMBL18883041 0.74 NOS1 (0.42) POLBGBA1
SCHEMBL18883042 0.74 NOS1 (0.42) POLBGBA1
SCHEMBL18883048 0.74 NOS1 (0.42) POLBGBA1
SCHEMBL18883040 0.74 NOS1 (0.42) POLBGBA1
SCHEMBL23255522 0.74 NOS1 (0.42) POLBGBA1
SCHEMBL23477650 0.72 POLB (0.47) POLBGBA1
SCHEMBL23477733 0.72 POLB (0.47) POLBGBA1
SCHEMBL13953752 0.72 POLB (0.47) POLBGBA1
SCHEMBL23459137 0.72 POLB (0.47) POLBGBA1

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
CN-110139929-A Bacterial glutaminyl cyclase and inhibitors thereof for the treatment of periodontitis 德国弗劳恩霍夫应用研究促进协会 2019-08-16 — — CN disclosed
Send feedback