SCHEMBL8515784

SCHEMBL8515784

COCCC=NC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
AKT1 P31749 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
POLB P06746 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 3/20 0.40
TSHR P16473 3/20 0.40
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
CA2 P00918 1/20 0.38
GAA P10253 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR2 P34972 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
SCHEMBL8512829 0.81 SMN1; SMN2 (0.42) HPGDSMN1; SMN2TDP1LMNATSHR
SCHEMBL4560875 0.78 CES1 (0.45) HPGDSMN1; SMN2TDP1LMNATSHR
SCHEMBL4039182 0.75 TDP1 (0.49) HPGDAKT1SMN1; SMN2POLBTDP1
SCHEMBL459926 0.73 ALDH1A1 (0.40) AKT1SMN1; SMN2POLBLMNATSHR
SCHEMBL15263885 0.72 EGFR (0.42) HPGDALDH1A1MAPTMAPK1KMT2A
SCHEMBL13268552 0.72 EGFR (0.42) HPGDALDH1A1MAPTMAPK1KMT2A
SCHEMBL10024365 0.70 TSHR (0.48) HPGDAKT1SMN1; SMN2POLBTDP1
SCHEMBL14479051 0.70 TSHR (0.48) HPGDAKT1SMN1; SMN2POLBTDP1
Benzophenone SCHEMBL9305650 0.70 ALDH1A1 (0.64) HPGDPOLBTDP1LMNATSHR
SCHEMBL28825945 0.70 CES1 (0.44) HPGDAKT1SMN1; SMN2POLBTDP1

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-2012070596-A1 ORGANOMETALLIC COMPLEX, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-05-31 WO disclosed