SCHEMBL26036028

SCHEMBL26036028

CC(C)=COCc1ccc(COCCOC2CCCCO2)nc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ICAM1 P05362 1/20 0.34
SELE P16581 1/20 0.34
CHEK1 O14757 2/20 0.32
CREBBP Q92793 1/20 0.31
P2RX3 P56373 1/20 0.31
MET P08581 2/20 0.30

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
SCHEMBL16998565 0.87 KDM4C (0.44) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL16998563 0.84 KDM4C (0.48) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL16998553 0.78 KDM4C (0.43) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL30935589 0.75 KDM4C (0.45) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL16998547 0.74 KDM4C (0.39) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL26035826 0.74 KDM4C (0.39) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL18106022 0.74 KDM4C (0.44) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL2568655 0.73 KDM4C (0.47) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL16998561 0.72 KDM4C (0.36) KDM4CNPC1RAB9AL3MBTL1MEN1
SCHEMBL21070800 0.71 KDM4C (0.42) KDM4CNPC1RAB9AL3MBTL1MEN1

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
EP-3058960-B1 DIAGNOSTIC AGENT FOR THERAPEUTIC EFFECT ON CANCER HAMAMATSU PHOTONICS KK (JP) 2023-08-30 EP disclosed