SCHEMBL22060751

SCHEMBL22060751

COc1c(Br)cc(C)c2c1N(C)C1(CCCC1)NC2=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.34
INSR P06213 1/20 0.34
IGF1R P08069 1/20 0.34
MKNK2 Q9HBH9 4/20 0.33
IMPDH2 P12268 1/20 0.33
ALDH1A1 P00352 2/20 0.31
MKNK1 Q9BUB5 7/20 0.31
MAPT P10636 2/20 0.31

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
SCHEMBL22060752 0.76 MAPT (0.39) TTRINSRIGF1RALDH1A1MAPT
SCHEMBL22061374 0.75 MAPT (0.40) TTRINSRIGF1RALDH1A1MAPT
SCHEMBL22061549 0.72 MKNK1 (0.62) MKNK1
SCHEMBL22061566 0.71 MKNK1 (0.62) MKNK1
SCHEMBL22061421 0.67 MKNK1 (0.30) MKNK2MKNK1
SCHEMBL22061375 0.65 PDE7A (0.36) TTRINSRIGF1RALDH1A1MAPT
SCHEMBL3296747 0.65 ALDH1A1 (0.42) TTRINSRIGF1RALDH1A1
SCHEMBL17362927 0.64 MKNK1 (0.55) MKNK2MKNK1
SCHEMBL22061372 0.64 PDE7A (0.38) TTRINSRIGF1RALDH1A1MAPT
SCHEMBL17362618 0.63 MKNK1 (0.57) MKNK2MKNK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111253397-B MNK inhibitors 上海迪诺医药科技有限公司 2023-11-14 CN disclosed
WO-2020108619-A1 MNK INHIBITOR 上海迪诺医药科技有限公司 2020-06-04 WO disclosed