SCHEMBL19986066

SCHEMBL19986066

c1ccc2c(c1)oc1ccc(-c3ccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)cc3)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
PLA2G2A P14555 3/20 0.34
PLA2G4A P47712 3/20 0.34
AHR P35869 2/20 0.32
ALOX5 P09917 1/20 0.32
CHEK2 O96017 1/20 0.31
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
BRCA1 P38398 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
SCHEMBL19986077 0.93 NPC1 (0.35) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL19986056 0.93 PLA2G2A (0.33) ALDH1A1MEN1KMT2AKDM4EPLA2G2A
SCHEMBL17405339 0.92 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL19986087 0.91 PLA2G2A (0.34) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL19986052 0.90 ALDH1A1 (0.38) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL19986020 0.89 PLA2G2A (0.38) ALDH1A1MEN1KMT2AKDM4EPLA2G2A
SCHEMBL19986042 0.89 KDM4E (0.37) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL19986007 0.89 KDM4E (0.37) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL19986060 0.89 KDM4E (0.40) ALDH1A1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL19986029 0.89 TDP1 (0.33) ALDH1A1MEN1KMT2APLA2G2APLA2G4A

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed