SCHEMBL15501236

SCHEMBL15501236

N=NCCCN1CCCC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
PIK3CD O00329 1/20 0.43
PKM P14618 1/20 0.42
TSHR P16473 2/20 0.42
ADRA1B P35368 4/20 0.40
ADRA1A P35348 1/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MALT1 Q9UDY8 1/20 0.40
CYP1A2 P05177 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40

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
SCHEMBL28532120 0.95 ADRA1B (0.43) KMT2AMEN1NPC1TP53RAB9A
SCHEMBL28383074 0.89 PIK3CD (0.46) KMT2AMEN1PIK3CDPKMTSHR
SCHEMBL4394145 0.85 KMT2A (0.47) KMT2AMEN1NPC1TP53RAB9A
SCHEMBL5424673 0.82 PIK3CD (0.54) KMT2AMEN1PIK3CDPKMTSHR
SCHEMBL13667810 0.81 PIK3CD (0.47) KMT2AMEN1NPC1TP53RAB9A
SCHEMBL16864473 0.81 KMT2A (0.45) KMT2AMEN1NPC1TP53RAB9A
SCHEMBL31632694 0.80 PIK3CD (0.52) KMT2AMEN1PIK3CDPKMTSHR
SCHEMBL989008 0.80 PIK3CD (0.52) KMT2AMEN1PIK3CDPKMTSHR
SCHEMBL19514132 0.80 PIK3CD (0.52) KMT2AMEN1PIK3CDPKMTSHR
SCHEMBL5697292 0.80 PIK3CD (0.52) KMT2AMEN1PIK3CDPKMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112608402-B Styrene block copolymer and preparation method thereof 北京化工大学 2022-02-11 CN claimed
CN-112608402-A Styrene block copolymer and preparation method thereof 北京化工大学 2021-04-06 CN claimed
CN-112608402-B Styrene block copolymer and preparation method thereof 北京化工大学 2022-02-11 CN disclosed
CN-112608402-A Styrene block copolymer and preparation method thereof 北京化工大学 2021-04-06 CN disclosed
WO-2015080665-A1 CHALCONE-UREA DERIVATIVES AS INSULIN SENSORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-06-04 WO disclosed
EP-2705753-A1 2-Phenyl-imidazolotriazinone compounds as PDE5 inhibitors Surface Logix, Inc. (US) 2014-03-12 EP disclosed