SCHEMBL31736623

SCHEMBL31736623

c1nc(NC2CCNCC2)ncc1C1CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.46
MAPK8 P45983 2/20 0.43
IKBKB O14920 1/20 0.42
MAPK1 P28482 4/20 0.42
HRH3 Q9Y5N1 1/20 0.41
HRH4 Q9H3N8 1/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
HDAC1 Q13547 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
CDK1 P06493 2/20 0.39
CDK4 P11802 2/20 0.39
CCND1 P24385 2/20 0.39
CDK2 P24941 2/20 0.39
CCNB1 P14635 1/20 0.39
CCNA2 P20248 1/20 0.39
CCNA1 P78396 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
SLC18A3 Q16572 1/20 0.38

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
SCHEMBL28729081 0.89 SYK (0.41) MAPK1
SCHEMBL22895358 0.89 SYK (0.41) MAPK1
SCHEMBL31619957 0.81 MAPK1 (0.64) IGF1RMAPK8IKBKBMAPK1HRH3
SCHEMBL14397338 0.81 HDAC1 (0.45) IGF1RMAPK8IKBKBMAPK1HRH3
SCHEMBL31736992 0.81 MAPK1 (0.64) IGF1RMAPK8IKBKBMAPK1HRH3
SCHEMBL4701457 0.81 IGF1R (0.46) IGF1RMAPK8IKBKBMAPK1HRH3
SCHEMBL22057257 0.79 ENPP2 (0.47) DDB1CRBNSLC18A3SIGMAR1
SCHEMBL29763119 0.79 KDM4E (0.48) IGF1RMAPK8IKBKBMAPK1HRH3
SCHEMBL1073617 0.79 KDM4E (0.64) MAPK8IKBKBMAPK1HRH3KDM4E
Hydrochloric Acid SCHEMBL23131043 0.78 ENPP2 (0.46) DDB1CRBNSLC18A3SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025245178-A1 PAK4, CSTF2, OR CSTF2T PROTEIN DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS INNOVO THERAPEUTICS, INC. (US) 2025-11-27 WO disclosed