SCHEMBL19333554

SCHEMBL19333554

COC(=O)/C=C/C(=O)Oc1ccc2ccccc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.53
MAPT P10636 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
CCNC P24863 1/20 0.51
CDK8 P49336 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2A6 P11509 1/20 0.50
KDM4E B2RXH2 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
FAAH O00519 1/20 0.47
EPHX1 P07099 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
HCAR2 Q8TDS4 1/20 0.45

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
SCHEMBL19333555 1.00 KMT2A (0.53) KMT2AMEN1MAPTTDP1CCNC
SCHEMBL14989047 0.84 KMT2A (0.54) KMT2AMEN1MAPTTDP1CYP1A2
SCHEMBL14989046 0.84 KMT2A (0.54) KMT2AMEN1MAPTTDP1CYP1A2
SCHEMBL19335930 0.84 KMT2A (0.59) KMT2AMEN1MAPTTDP1KDM4E
SCHEMBL15599299 0.84 KMT2A (0.59) KMT2AMEN1MAPTTDP1KDM4E
SCHEMBL19721639 0.82 CCNC (0.54) KMT2AMEN1MAPTTDP1CCNC
SCHEMBL5673590 0.81 KDM4E (0.62) KMT2AMAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL5673587 0.81 KDM4E (0.62) KMT2AMAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL20126398 0.81 HCAR2 (0.62) KMT2AMEN1MAPTCYP1A2KDM4E
SCHEMBL20129480 0.81 HCAR2 (0.62) KMT2AMEN1MAPTCYP1A2KDM4E

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-9761804-B2 Oligomeric organic light emitting diode (OLED) materials containing multiple crosslinking functions LOMOX LIMITED (GB) 2017-09-12 US disclosed
US-9761804-B2 Oligomeric organic light emitting diode (OLED) materials containing multiple crosslinking functions LOMOX LIMITED (GB) 2017-09-12 US disclosed