SCHEMBL29129334

SCHEMBL29129334

Cc1c(Br)ccc2ccncc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.46
CLK1 P49759 1/20 0.42
DYRK1A Q13627 1/20 0.42
IMPDH2 P12268 1/20 0.40
TNF P01375 1/20 0.39
CCNT1 O60563 1/20 0.39
PIM1 P11309 1/20 0.39
CDK9 P50750 1/20 0.39
HASPIN Q8TF76 1/20 0.39
TOP2A P11388 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
MAOA P21397 2/20 0.37
MAPK10 P53779 3/20 0.37
HIPK2 Q9H2X6 1/20 0.37
KIT P10721 1/20 0.36
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL30481321 0.86 IMPDH2 (0.52) AXLDYRK1AIMPDH2CCNT1PIM1
SCHEMBL25217587 0.86 IMPDH2 (0.52) AXLDYRK1AIMPDH2CCNT1PIM1
SCHEMBL8404561 0.78 CYP2A6 (0.52) CLK1DYRK1ATNFTOP2AHTR2A
SCHEMBL21050856 0.78 IMPDH2 (0.43) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL29751627 0.78 AXL (0.44) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL24608162 0.78 AXL (0.44) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL29987653 0.78 CCNT1 (0.45) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL22981109 0.78 CCNT1 (0.45) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL29751463 0.78 IMPDH2 (0.43) AXLCLK1DYRK1AIMPDH2TNF
SCHEMBL29751387 0.77 MAOA (0.60) AXLCLK1DYRK1AIMPDH2TNF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4720038-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2026-04-08 EP disclosed
WO-2024246496-A1 (HETERO)ARYL-CARBONYL-HETEROBICYCLIC COMPOUNDS AS INHIBITORS OF PMS2 FOR CANCER AND DEGENERATIVE ILLNESSES Neophore Limited (GB) 2024-12-05 WO disclosed
CN-117279896-A Amino substituted pyrido ring compounds, preparation method and application thereof 劲方医药科技(上海)有限公司 2023-12-22 CN disclosed
WO-2022214044-A1 AMINE-SUBSTITUTED PYRIDINE FUSED RING COMPOUNDS, PREPARATION METHOD THEREFOR AND USE THEREOF 劲方医药科技(上海)有限公司 2022-10-13 WO disclosed