SCHEMBL19986127

SCHEMBL19986127

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c3)c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
BRCA1 P38398 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALPI P09923 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
HPGD P15428 1/20 0.31
CASP3 P42574 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
CASP7 P55210 1/20 0.31
CASP6 P55212 1/20 0.31
MCL1 Q07820 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
SCHEMBL19986199 0.91 MAPT (0.34) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL19039796 0.91 MEN1 (0.34) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL19986057 0.89 ALDH1A1 (0.34) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL19986008 0.88 PLA2G2A (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL19986025 0.88 PLA2G2A (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL17405359 0.88 ALDH1A1 (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL17406083 0.88 ALDH1A1 (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL17406087 0.88 ALDH1A1 (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL17405360 0.88 ALDH1A1 (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB
SCHEMBL17405639 0.87 MAPT (0.35) MEN1KMT2AHSD17B10ALDH1A1POLB

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