SCHEMBL11222456

SCHEMBL11222456

Oc1ccc(NCCCCl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.43
▸ PDK1 Q15118 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ PDK3 Q15120 1/20 0.39
▸ PDK4 Q16654 1/20 0.39
▸ TTR P02766 1/20 0.38
▸ TNIK Q9UKE5 1/20 0.38
▸ BACE1 P56817 1/20 0.38
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ESR1 P03372 5/20 0.36
▸ CAMK2A Q9UQM7 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35

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
SCHEMBL11232288 0.77 TDP1 (0.49) MAPTMEN1KMT2A
SCHEMBL11115835 0.76 CCR1 (0.35) HSD17B10MAPTMEN1PKMHTT
SCHEMBL11118699 0.75 MAPT (0.44) HSD17B10MAPTKDM4EMEN1HTT
SCHEMBL11229172 0.73 LTA4H (0.38) HSD17B10PDK1PDK2PDK3PDK4
SCHEMBL11225305 0.73 KDM4E (0.39) HSD17B10PDK1PDK2PDK3PDK4
SCHEMBL6323843 0.72 APP (0.46) HSD17B10MAPTKDM4EESR1MEN1
SCHEMBL11112106 0.72 CCR1 (0.46) MEN1KMT2ACCR1
SCHEMBL13174008 0.71 HSD17B10 (0.54) HSD17B10PDK1PDK2PDK3PDK4
SCHEMBL28979837 0.70 HSD17B10 (0.52) HSD17B10PDK1PDK2PDK3PDK4
SCHEMBL11478283 0.69 ABL1 (0.51) HSD17B10MAPTKDM4EESR1MEN1

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
US-4341403-A Fluoran compounds, process for preparation thereof, and recording sheets using same FUJI PHOTO FILM CO., LTD. (JP) 1982-07-27 — — US disclosed
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