SCHEMBL31026280

SCHEMBL31026280

COc1cc(C2(C(F)(F)F)CC2)ccc1Nc1ccc2cccc(Cl)c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 2/20 0.35
LRRK2 Q5S007 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
TTK P33981 5/20 0.33
CTSC P53634 2/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
PIM1 P11309 1/20 0.33
PIM2 Q9P1W9 1/20 0.33
GAA P10253 2/20 0.32
MAPK11 Q15759 1/20 0.32
MAPK14 Q16539 1/20 0.32
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MCHR1 Q99705 1/20 0.32
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
SCHEMBL31058639 0.81 XPO1 (0.38) XPO1CTSCPIM1PIM2MCHR1
SCHEMBL31026255 0.80 XPO1 (0.38) XPO1PIM1PIM2MAPTRAB9A
SCHEMBL31026251 0.79 XPO1 (0.38) XPO1CTSCPIM1PIM2NPC1
SCHEMBL31026267 0.78 KDM4E (0.38) XPO1PIM1PIM2NPC1RAB9A
SCHEMBL31026247 0.76 XPO1 (0.37) XPO1CTSCMCHR1
SCHEMBL31026269 0.73 XPO1 (0.42) XPO1PIM1PIM2NPC1RAB9A
SCHEMBL31026271 0.72 XPO1 (0.39) XPO1CTSCPIM1PIM2NPC1
SCHEMBL31026263 0.72 XPO1 (0.38) XPO1PIM1PIM2NPC1RAB9A
SCHEMBL31026273 0.71 XPO1 (0.37) XPO1CTSCPIM1PIM2NPC1
SCHEMBL31026253 0.71 XPO1 (0.37) XPO1PIM1PIM2NPC1RAB9A

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 3 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
CN-118373771-A Quinoline derivative compound or pharmaceutically acceptable salt thereof, and preparation method and application thereof 江苏柯菲平医药股份有限公司 2024-07-23 CN disclosed