SCHEMBL21031250

SCHEMBL21031250

CC1C=CC=CC1c1cc(I)cc(-c2ccccc2)c1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 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
SCHEMBL28036409 0.76 CYP2C19 (0.42)
SCHEMBL13523502 0.75
SCHEMBL24297478 0.72 MAPT (0.43) HTTSMN1; SMN2
SCHEMBL22147068 0.72 KDM1A (0.37) KDM4ESMN1; SMN2
SCHEMBL19622957 0.72 KDM1A (0.37) KDM4ESMN1; SMN2
SCHEMBL25860926 0.71 ALDH1A1 (0.41) KDM4E
SCHEMBL21892151 0.70 ALDH1A1 (0.53) KDM4EHTTSMN1; SMN2
SCHEMBL16901964 0.70 ALDH1A1 (0.53)
SCHEMBL2194491 0.70 ALDH1A1 (0.53)
SCHEMBL26749729 0.69 LMNA (0.46) KDM4ESMN1; SMN2

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-2513996-B1 ORGANIC LIGHT EMITTING DEVICE CANON KK (JP) 2019-05-29 EP disclosed