SCHEMBL23384697

SCHEMBL23384697

O=C1NC(O)C(CNC(=O)c2cnn(-c3ccccc3)n2)(c2ccccn2)N1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADAMTS7 Q9UKP4 13/20 0.61
HDAC1 Q13547 2/20 0.43
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL23354934 0.80 ADAMTS7 (0.62) ADAMTS7HDAC1
SCHEMBL29873733 0.80 ADAMTS7 (0.62) ADAMTS7HDAC1
SCHEMBL29873604 0.80 ADAMTS7 (0.62) ADAMTS7HDAC1
SCHEMBL24938697 0.79 ADAMTS7 (0.57) ADAMTS7HDAC1NPC1RAB9A
SCHEMBL23367505 0.78 ADAMTS7 (0.60) ADAMTS7HDAC1
SCHEMBL23354758 0.76 ADAMTS7 (1.00) ADAMTS7HDAC1
SCHEMBL23354809 0.75 ADAMTS7 (0.93) ADAMTS7HDAC1
SCHEMBL24938721 0.75 ADAMTS7 (0.93) ADAMTS7HDAC1
SCHEMBL23354855 0.75 ADAMTS7 (0.93) ADAMTS7HDAC1
SCHEMBL29873473 0.75 ADAMTS7 (0.93) ADAMTS7HDAC1

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-2021094434-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2021-05-20 WO disclosed