SCHEMBL4162489

SCHEMBL4162489

[c]1cc2c3ccccc3nn2c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.35
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 3/20 0.35
TSHR P16473 2/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 0.33
TP53 P04637 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
MPO P05164 2/20 0.33
KDM1A O60341 1/20 0.31
MAOA P21397 2/20 0.31
GLA P06280 1/20 0.31
CHRM2 P08172 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 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
SCHEMBL12145717 0.69 KDM4E (0.41) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL360907 0.67 KDM4E (0.46) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL18130849 0.66 MPO (0.40) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL15953657 0.66 KDM4E (0.38) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL361865 0.63 KDM4E (0.40) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL10063493 0.63 BACE1 (0.45) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL51669 0.62 KDM4E (0.41) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL69767 0.62 KDM4E (0.34) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL4875167 0.61 MAPT (0.46) KDM4EALDH1A1HSD17B10TSHRLMNA
SCHEMBL80903 0.61 KDM4E (0.33) KDM4EALDH1A1HSD17B10TSHRLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090243473-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2009-10-01 US disclosed
EP-2053672-A1 ORGANIC ELECTROLUMINESCENCE DEVICE Idemitsu Kosan Co., Ltd. (JP) 2009-04-29 EP disclosed