SCHEMBL19009455

SCHEMBL19009455

CCc1nc2ccccc2c2ccc3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
RAD52 P43351 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KMT2A Q03164 2/20 0.44
HPGD P15428 3/20 0.42
MAPK1 P28482 2/20 0.42
HSD17B10 Q99714 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 2/20 0.42
CYP3A4 P08684 2/20 0.42
TSHR P16473 1/20 0.42
CASP1 P29466 1/20 0.42
RAB9A P51151 1/20 0.42
CASP7 P55210 1/20 0.42
HIF1A Q16665 1/20 0.42
GAA P10253 2/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
GPR3 P46089 1/20 0.40

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
SCHEMBL17036576 0.86 POLB (0.49) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL18748049 0.83 POLB (0.50) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL5213764 0.83 POLB (0.45) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL19051729 0.80 POLB (0.49) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL19009449 0.78 KDM4E (0.47) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL12533981 0.77 KMT2A (0.64) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL18907237 0.77 CYP1A2 (0.47) POLBSMN1; SMN2KMT2AHPGDMAPK1
SCHEMBL17997841 0.75 POLB (0.51) POLBRAD52SMN1; SMN2KMT2AHPGD
SCHEMBL18907186 0.74 CYP1A2 (0.47) KMT2AHPGDMAPK1HSD17B10L3MBTL1
SCHEMBL18907233 0.74 CYP1A2 (0.51) SMN1; SMN2KMT2AHPGDRAB9AGAA

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-20170179402-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-22 US disclosed