SCHEMBL21799550

SCHEMBL21799550

CC(C)CCCNc1ccccc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.42
HDAC3 O15379 4/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC2 Q92769 3/20 0.39
NCOR2 Q9Y618 2/20 0.39
MAPT P10636 4/20 0.38
HTT P42858 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
GAA P10253 2/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37

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
SCHEMBL22512304 0.93 HDAC3 (0.43) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL7741393 0.89 CYP1A2 (0.42) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL29922638 0.89 CYP1A2 (0.42) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL3872964 0.83 HDAC6 (0.38) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL867417 0.82 PRSS1 (0.47) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL215272 0.82 HDAC3 (0.50) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL8720375 0.81 HDAC3 (0.53) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL6247309 0.81 HDAC3 (0.53) HDAC6HDAC3HDAC1HDAC2NCOR2
SCHEMBL21267252 0.80 MAPT (0.39) MAPTHTTGAAKDM4EMEN1
SCHEMBL10408237 0.80 MAPT (0.64) MAPTHTTGAAMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110603273-B Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2022-10-14 CN disclosed
US-11124593-B2 Modified block copolymer, method for producing modified block copolymer, and resin composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2021-09-21 US disclosed
US-20200199282-A1 Modified Block Copolymer, Method for Producing Modified Block Copolymer, and Resin Composition ASAHI KASEI KABUSHIKI KAISHA (JP) 2020-06-25 US disclosed
EP-3623398-A1 MODIFIED BLOCK COPOLYMER, METHOD FOR PRODUCING MODIFIED BLOCK COPOLYMER, AND RESIN COMPOSITION Asahi Kasei Kabushiki Kaisha (JP) 2020-03-18 EP disclosed
CN-110603273-A Modified block copolymer, method for producing modified block copolymer, and resin composition 旭化成株式会社 2019-12-20 CN disclosed