SCHEMBL7862292

SCHEMBL7862292

C=Cc1c(COC)cccc1COC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.35
GABRA1 P14867 3/20 0.33
GABRB2 P47870 3/20 0.33
FFAR1 O14842 1/20 0.32
HTT P42858 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
ALOX12 P18054 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 3/20 0.31
ALDH1A1 P00352 3/20 0.31
KMT2A Q03164 3/20 0.31
IDO1 P14902 3/20 0.31
PRKCE Q02156 2/20 0.31
MYLK Q15746 2/20 0.31
PRKCG P05129 1/20 0.31
MAPT P10636 1/20 0.31
PRKCA P17252 1/20 0.31
APEX1 P27695 1/20 0.31

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
SCHEMBL487193 0.88 ALDH1A1 (0.32) PDK2MEN1ALDH1A1KMT2AGAA
SCHEMBL7868954 0.79 HPGD (0.31) HTTNPSR1KDM4ENPC1ALOX12
SCHEMBL1055512 0.78 IGF1R (0.39) PDK2GABRA1GABRB2HTTNPSR1
SCHEMBL58238 0.77 ALDH1A1 (0.40) PDK2FFAR1HTTNPSR1KDM4E
SCHEMBL31602197 0.77 ALDH1A1 (0.40) PDK2FFAR1HTTNPSR1KDM4E
SCHEMBL7868953 0.77 TDP1 (0.35) MEN1ALDH1A1KMT2APRKCEMYLK
SCHEMBL1363486 0.77 GABRA1 (0.50) PDK2GABRA1GABRB2NPSR1MAPT
SCHEMBL7870078 0.76 ALDH1A1 (0.32) PDK2HTTNPSR1KDM4ENPC1
SCHEMBL2518480 0.76 L3MBTL1 (0.40) HTTNPSR1KDM4ENPC1ALOX12
SCHEMBL6056491 0.75 ALDH1A1 (0.36) PDK2MEN1ALDH1A1KMT2AGAA

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-6299785-B1 Electrode formation process JSR CORPORATION (JP) 2001-10-09 US disclosed