SCHEMBL23627795

SCHEMBL23627795

Cc1cccc2c1sc1ccc(F)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
MAPT P10636 4/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
HCRTR1 O43613 1/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MPI P34949 5/20 0.38
PMM2 O15305 3/20 0.38
PHOSPHO1 Q8TCT1 3/20 0.38
APOBEC3G Q9HC16 3/20 0.36
G6PD P11413 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HRH4 Q9H3N8 1/20 0.36
CYP1A2 P05177 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
SCHEMBL17899830 0.82 MPI (0.40) MAPTALDH1A1LMNAPOLBL3MBTL1
SCHEMBL15639371 0.82 CYP1A2 (0.46) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL30278835 0.82 CYP1A2 (0.46) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL11711098 0.79 ALDH1A1 (0.44) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL24343668 0.79 MAPT (0.53) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL19346501 0.79 IDO1 (0.40) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL18094588 0.78 CYP1A2 (0.41) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL731864 0.77 GPR3 (0.54) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL29388065 0.77 GPR3 (0.54) MAPTALDH1A1LMNAHCRTR1POLB
SCHEMBL24422196 0.77 KIF11 (0.42) MAPTALDH1A1LMNAHCRTR1POLB

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-2021135517-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2021-07-08 WO disclosed