SCHEMBL21457769

SCHEMBL21457769

CCCOC(=O)C(C#N)=Cc1ccc(N(CC)CC)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.66
MEN1 O00255 7/20 0.66
KMT2A Q03164 7/20 0.66
MAPT P10636 6/20 0.66
POLB P06746 2/20 0.66
MAPK1 P28482 4/20 0.59
L3MBTL1 Q9Y468 4/20 0.59
TDP1 Q9NUW8 3/20 0.59
NPSR1 Q6W5P4 2/20 0.59
LMNA P02545 2/20 0.58
USP2 O75604 1/20 0.58
RECQL P46063 1/20 0.58
BLM P54132 1/20 0.58
KDM4E B2RXH2 1/20 0.53
DNM1 Q05193 3/20 0.52
NPC1 O15118 1/20 0.48
CASP3 P42574 1/20 0.48
RAB9A P51151 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48

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
SCHEMBL21457767 1.00 ALDH1A1 (0.66) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14701171 0.95 ALDH1A1 (0.69) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14129171 0.93 MEN1 (0.60) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14701164 0.92 MEN1 (0.66) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14701173 0.91 MEN1 (0.64) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14701165 0.91 MEN1 (0.64) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL21457457 0.90 ALDH1A1 (0.69) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL14701316 0.90 ALDH1A1 (0.69) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL11071030 0.89 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL11071019 0.89 ALDH1A1 (0.63) ALDH1A1MEN1KMT2AMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
US-20200095358-A1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORPORATION (JP) 2020-03-26 US disclosed
EP-3553097-A1 COPOLYMER AND OPTICAL FILM USING SAME Tosoh Corporation (JP) 2019-10-16 EP disclosed