SCHEMBL23959429

SCHEMBL23959429

CC(C)(C)c1cccc(-c2ccc(I)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.61
RXRA P19793 3/20 0.59
RXRB P28702 3/20 0.59
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
PTPN5 P54829 3/20 0.39
DHODH Q02127 1/20 0.39
ASIC1 P78348 1/20 0.39
PTPN1 P18031 2/20 0.39
RXRG P48443 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
CNR1 P21554 1/20 0.37
ACHE P22303 1/20 0.37
MAOB P27338 1/20 0.37
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL27659191 0.87 KIF11 (0.76) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL17105790 0.85 KIF11 (0.68) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL5547288 0.85 KIF11 (0.72) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL30023786 0.85 KIF11 (0.72) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL17864482 0.85 RXRA (0.47) KIF11RXRARXRBPTPN5PTPN1
SCHEMBL13816684 0.83 RXRA (0.46) KIF11RXRARXRBPTPN5PTPN1
SCHEMBL779683 0.83 KIF11 (0.70) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL25693197 0.81 KIF11 (0.68) KIF11RXRARXRBHDAC4HDAC2
SCHEMBL30257771 0.81 RXRB (0.55) KIF11RXRARXRBRXRGMAPT
SCHEMBL25706667 0.81 KIF11 (0.67) KIF11RXRARXRBHDAC4HDAC2

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-2021213109-A1 ARYLAMINE COMPOUND, ELECTRONIC COMPONENT USING SAME AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 (CN) 2021-10-28 WO disclosed