SCHEMBL29922677

SCHEMBL29922677

CCCNc1cccc(N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
CYP3A4 P08684 3/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 3/20 0.47
DDX3X O00571 2/20 0.46
RAPGEF4 Q8WZA2 1/20 0.44
CASP1 P29466 1/20 0.42
RECQL P46063 1/20 0.42
FYN P06241 1/20 0.42

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
SCHEMBL4745533 1.00 MAPT (0.48) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL8168701 0.89 F2R (0.47) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL4611763 0.87 ABL1 (0.47) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL21799643 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL5604882 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL21799446 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL3397885 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL21799443 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL21799532 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA
SCHEMBL21799916 0.85 TSHR (0.50) MAPTCYP3A4KDM4EMEN1LMNA

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 1 patent. 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