SCHEMBL25025652

SCHEMBL25025652

CCCC(CC)c1ccncc1C(C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RPS6KA3 P51812 1/20 0.36
LIMK1 P53667 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL19173619 0.81 KDM4E (0.38) KDM4ESMN1; SMN2LMNAMAPTMAPK1
SCHEMBL19003682 0.79 LOXL2 (0.38) KDM4ESMN1; SMN2RPS6KA3
SCHEMBL22260141 0.79 KDM4E (0.37) KDM4ESMN1; SMN2
SCHEMBL24920247 0.79 GAA (0.37) KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL18469769 0.79 KDM4E (0.37) KDM4ESMN1; SMN2RPS6KA3
SCHEMBL18557486 0.78 TSHR (0.39) SMN1; SMN2RPS6KA3LIMK1LMNA
SCHEMBL25027731 0.78 CYP2E1 (0.41) KDM4ESMN1; SMN2
SCHEMBL269127 0.77 RPS6KA3 (0.46) RPS6KA3LIMK1LMNAMAPT
SCHEMBL19831937 0.76 KDM4E (0.37) KDM4ESMN1; SMN2LIMK1LMNAMAPT
SCHEMBL24481241 0.74 TSHR (0.44) SMN1; SMN2RPS6KA3LIMK1LMNA

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-2023017263-A1 POTASSIUM CHANNEL MODULATORS AUTIFONY THERAPEUTICS LIMITED (GB) 2023-02-16 WO disclosed