SCHEMBL19823005

SCHEMBL19823005

CCN(CCO)c1ccc(N=Nc2ccc(N=Nc3ccc(C(F)(F)F)cc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
MAPT P10636 3/20 0.54
PSMD14 O00487 1/20 0.54
MITF O75030 1/20 0.54
NR1H2 P55055 5/20 0.43
NR1H3 Q13133 5/20 0.43
LMNA P02545 4/20 0.40
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NOS1 P29475 4/20 0.39
NOS3 P29474 3/20 0.39
ALDH1A1 P00352 3/20 0.39
NOS2 P35228 2/20 0.39
BLM P54132 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL19823007 0.91 MAPT (0.43) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL9235923 0.91 MAPT (0.43) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL12069741 0.88 TDP1 (0.50) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL25485940 0.87 KMT2A (0.65) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL19823016 0.85 MAPT (0.40) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL16222277 0.83 KMT2A (0.58) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL20566720 0.83 KMT2A (0.58) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL19823003 0.82 HTR3E (0.39) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL19822977 0.82 SLC9A5 (0.40) KMT2ANPC1RAB9AMAPTPSMD14
SCHEMBL4638072 0.81 KMT2A (0.59) KMT2ANPC1RAB9AMAPTPSMD14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10731078-B2 Composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-08-04 US disclosed
US-20180030354-A1 COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed
US-20180030354-A1 COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-02-01 US disclosed