SCHEMBL31060929

SCHEMBL31060929

CCNc1nc(NC2CCCCC2)c2nc[nH]c2n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 8/20 0.68
CDK1 P06493 2/20 0.45
CDK2 P24941 2/20 0.45
CCNB2 O95067 1/20 0.45
CCNB1 P14635 1/20 0.45
CCNA2 P20248 1/20 0.45
CCNA1 P78396 1/20 0.45
CCNB3 Q8WWL7 1/20 0.45
ADORA1 P30542 6/20 0.44
ADORA2A P29274 5/20 0.43
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
PKM P14618 1/20 0.42
HSD17B10 Q99714 1/20 0.42
FLT3 P36888 2/20 0.41
TYRO3 Q06418 2/20 0.41
MERTK Q12866 2/20 0.41
GAS6 Q14393 2/20 0.41
AXL P30530 1/20 0.41
PAK1 Q13153 1/20 0.41

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
SCHEMBL31061109 0.83 ADORA3 (0.71) ADORA3CDK1CDK2CCNB2CCNB1
SCHEMBL16146300 0.82 ADORA3 (0.52) ADORA3ADORA1ADORA2ALMNAHTT
SCHEMBL16146780 0.82 ADORA3 (0.51) ADORA3ADORA1ADORA2ALMNAHTT
SCHEMBL16146498 0.80 LMNA (0.47) ADORA3ADORA1ADORA2ALMNAHTT
SCHEMBL16146181 0.78 LMNA (0.46) ADORA3ADORA1LMNAHTTPKM
SCHEMBL21601510 0.78 ADORA3 (0.69) ADORA3ADORA1ADORA2ATYRO3MERTK
SCHEMBL31061104 0.78 ADORA3 (0.69) ADORA3ADORA1ADORA2ATYRO3MERTK
SCHEMBL21601504 0.78 ADORA3 (0.69) ADORA3ADORA1ADORA2ATYRO3MERTK
SCHEMBL21601563 0.78 ADORA3 (0.69) ADORA3ADORA1ADORA2ATYRO3MERTK
SCHEMBL1803029 0.77 LMNA (0.47) ADORA3ADORA1ADORA2ALMNAHTT

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-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed