SCHEMBL5333560

SCHEMBL5333560

COc1ccc(Nc2cncc3sccc23)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45
TUBA1A Q71U36 1/20 0.45
TUBA1C Q9BQE3 1/20 0.45
TUBB6 Q9BUF5 1/20 0.45
TUBB2B Q9BVA1 1/20 0.45
TUBB1 Q9H4B7 1/20 0.45
CSNK2A1 P68400 1/20 0.45
GAA P10253 1/20 0.45
NPC1 O15118 3/20 0.45

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
SCHEMBL5332098 0.90 MEN1 (0.49) MEN1KMT2ACSNK2A1GAANPC1
SCHEMBL5313426 0.83 PTGS1 (0.46) MEN1KMT2ACSNK2A1GAANPC1
SCHEMBL5335650 0.80 EPAS1 (0.43) MEN1KMT2ACSNK2A1NPC1RAB9A
SCHEMBL5339343 0.80 ICAM1 (0.42) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL5337352 0.79 GAA (0.43) MEN1KMT2ACSNK2A1GAANPC1
SCHEMBL5330795 0.79 IRAK4 (0.47) MEN1KMT2ANPC1MAPTKDM4E
SCHEMBL5329633 0.78 KMT2A (0.52) MEN1KMT2ARAB9AALOX5
SCHEMBL5336441 0.75 CSNK2A1 (0.39) MEN1KMT2ACSNK2A1NPC1RAB9A
SCHEMBL5340653 0.75 EPAS1 (0.39) MEN1KMT2ACSNK2A1NPC1RAB9A
SCHEMBL5331010 0.75 CSNK2A1 (0.51) MEN1KMT2ACSNK2A1GAARAB9A

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
WO-2007056215-A9 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA INC (US) 2007-09-13 WO disclosed
WO-2007056215-A2 N-ARYL-THIENOPYRIMIDIN-4-AMINES AND THE USE THEREOF CYTOVIA, INC. (US) 2007-05-18 WO disclosed