SCHEMBL21092964

SCHEMBL21092964

Fc1c(-n2c3ccccc3c3cc(-c4ccc5oc6ccccc6c5c4)ccc32)c(-n2c3ccccc3c3cc(-c4ccc5oc6ccccc6c5c4)ccc32)c(F)c(-n2c3ccccc3c3cc(-c4ccc5oc6ccccc6c5c4)ccc32)c1-n1c2ccccc2c2cc(-c3ccc4oc5ccccc5c4c3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
HPGD P15428 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RAB9A P51151 1/20 0.41
AHR P35869 2/20 0.38
PLA2G2A P14555 4/20 0.37
PLA2G4A P47712 4/20 0.37
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
CHEK2 O96017 1/20 0.36
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
TNKS O95271 1/20 0.35
PARP1 P09874 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
SCHEMBL21092958 0.92 MAPT (0.38) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL18265969 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL11885215 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL17248354 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL12892303 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL11987365 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL14867892 0.87 KDM4E (0.42) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL20706764 0.86 KDM4E (0.41) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL20706645 0.86 KDM4E (0.41) MAPTALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL10042642 0.86 KDM4E (0.43) MAPTALDH1A1KDM4ENPC1SMN1; 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
US-20190181353-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-06-13 US disclosed