SCHEMBL31546232

SCHEMBL31546232

O=C1c2cccc(Br)c2CCC12CC2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.49
PARP11 Q9NR21 1/20 0.49
CDK5 Q00535 2/20 0.43
PIM1 P11309 1/20 0.43
CSNK1A1 P48729 1/20 0.43
ROCK1 Q13464 1/20 0.43
DYRK1A Q13627 1/20 0.43
LRRK2 Q5S007 1/20 0.43
CLK4 Q9HAZ1 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
SIGMAR1 Q99720 9/20 0.41
HTR2A P28223 7/20 0.41
HTR2C P28335 7/20 0.41
HTR2B P41595 7/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
DRD2 P14416 7/20 0.36
CCNB2 O95067 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
SCHEMBL30842141 0.93 PARP10 (0.46) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL4317715 0.84 PARP10 (0.50) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL23980585 0.81 PARP10 (0.47) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL28502513 0.75 PARP10 (0.45) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL7923840 0.74 PARP10 (0.42) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL19041482 0.73 LDHA (0.35) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL7052870 0.72 PARP10 (0.58) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL8779031 0.72 SIGMAR1 (0.40) SIGMAR1HTR2AHTR2CHTR2BDRD2
SCHEMBL23980062 0.72 SMN1; SMN2 (0.52) PARP10PARP11CDK5PIM1CSNK1A1
SCHEMBL18440344 0.71 SIGMAR1 (0.41) PARP10PARP11SIGMAR1HTR2AHTR2C

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-4567032-A1 KIF18A INHIBITOR COMPOUND, AND PHARMACEUTICAL COMPOSITION AND PREPARATION METHOD THEREFOR AND USE THEREOF Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2025-06-11 EP disclosed
CN-119731163-A KIF18A inhibitor compound, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2025-03-28 CN disclosed