SCHEMBL7368022

SCHEMBL7368022

CC1(C)C=C(n2cc(Br)cc(N)c2=O)c2cccnc2O1

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 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
SCHEMBL7288576 0.89 POLB (0.34)
SCHEMBL7301120 0.87 NR4A2 (0.31) MAPT
SCHEMBL7379309 0.85 POLB (0.33)
SCHEMBL7288963 0.83 NPC1 (0.33) MAPTRAB9A
SCHEMBL7372112 0.83 NPC1 (0.32) MEN1MAPTHTTRAB9AKMT2A
SCHEMBL7348702 0.82 MEN1 (0.30) MEN1MAPTHTTKMT2A
SCHEMBL7373402 0.82 S100A4 (0.32) MEN1MAPTKMT2A
SCHEMBL7299711 0.80 WEE1 (0.31) MAPTRAB9A
SCHEMBL7374296 0.78 CCNC (0.38)
SCHEMBL7376009 0.78 AURKA (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0308792-B1 AZACHROMANE DERIVATIVES MERCK PATENT GmbH (DE) 1993-07-28 EP disclosed
US-4931454-A Azachroman derivatives with effects on the cardiovascular system MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-06-05 US disclosed