SCHEMBL24713290

SCHEMBL24713290

C=C(Nc1nc2c(OC)ncc(-c3ccccc3)c2s1)c1ccc(N(CC)CC)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.35
MAPT P10636 7/20 0.34
LMNA P02545 2/20 0.34
CFTR P13569 1/20 0.34
MEN1 O00255 6/20 0.33
KMT2A Q03164 6/20 0.33
ALDH1A1 P00352 4/20 0.33
RXFP1 Q9HBX9 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
GAA P10253 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
ADORA2A P29274 1/20 0.33
NPSR1 Q6W5P4 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 2/20 0.32

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
SCHEMBL30127848 0.89 ADORA1 (0.43) GHSRMAPTMEN1KMT2ARXFP1
SCHEMBL22027659 0.89 ADORA1 (0.43) GHSRMAPTMEN1KMT2ARXFP1
SCHEMBL24713476 0.85 ADORA2A (0.40) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL24713307 0.80 MAPT (0.37) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL24713254 0.77 ADORA1 (0.44) LMNAMEN1KMT2ARXFP1NPC1
SCHEMBL20702503 0.76 ADORA2A (0.48) MAPTLMNAADORA2ANPSR1GFER
SCHEMBL29607036 0.75 CSNK2A2 (0.49) MEN1KMT2ARXFP1NPC1RAB9A
SCHEMBL24349424 0.75 CSNK2A2 (0.49) MEN1KMT2ARXFP1NPC1RAB9A
SCHEMBL20702421 0.75 ADORA1 (0.47) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL20702388 0.74 CSNK2A1 (0.46) MEN1KMT2AALDH1A1RXFP1NPC1

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
EP-3661941-B1 THIAZOLOPYRIDINE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2022-12-14 EP disclosed