SCHEMBL31058639

SCHEMBL31058639

FC(F)(F)C1(c2cccc(Nc3ccc4cccc(Cl)c4n3)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 2/20 0.38
PIM1 P11309 9/20 0.36
PIM2 Q9P1W9 9/20 0.36
SIGMAR1 Q99720 1/20 0.35
AURKA O14965 1/20 0.33
MCHR1 Q99705 1/20 0.33
PTGES O14684 1/20 0.33
DHFR P00374 1/20 0.32
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
ROCK1 Q13464 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
CTSC P53634 1/20 0.32

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
SCHEMBL31026255 0.89 XPO1 (0.38) XPO1PIM1PIM2SIGMAR1MCHR1
SCHEMBL31026267 0.85 KDM4E (0.38) XPO1PIM1PIM2SIGMAR1AURKA
SCHEMBL31026276 0.84 BACE1 (0.34) PIM1PIM2SIGMAR1
SCHEMBL31026251 0.83 XPO1 (0.38) XPO1PIM1PIM2MCHR1CTSC
SCHEMBL31026273 0.82 XPO1 (0.37) XPO1PIM1PIM2MCHR1CTSC
SCHEMBL31026247 0.82 XPO1 (0.37) XPO1MCHR1CTSC
SCHEMBL31026280 0.81 XPO1 (0.35) XPO1PIM1PIM2MCHR1CTSC
SCHEMBL31026275 0.81 XPO1 (0.36) XPO1PIM1PIM2MCHR1CTSC
SCHEMBL30603859 0.79 AURKA (0.54) AURKACTSC
SCHEMBL29110578 0.79 AURKA (0.54) AURKACTSC

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
EP-4635942-A1 QUINOLINE DERIVATIVE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Carephar Pharmaceutical Co., Ltd (CN) 2025-10-22 EP disclosed
WO-2024152743-A1 QUINOLINE DERIVATIVE COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏柯菲平医药股份有限公司 2024-07-25 WO disclosed