SCHEMBL19986111

SCHEMBL19986111

c1ccc(-c2cccc(-c3nc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c4ccccc4n3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.36
ACP1 P24666 2/20 0.36
MAPK1 P28482 4/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP1A2 P05177 5/20 0.35
CYP3A4 P08684 5/20 0.35
CYP2D6 P10635 4/20 0.35
LMNA P02545 4/20 0.35
TP53 P04637 2/20 0.35
USP2 O75604 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
ABCG2 Q9UNQ0 4/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 2/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL19986108 0.93 ACP1 (0.40) TSHRACP1MAPK1MEN1ALDH1A1
SCHEMBL19986107 0.93 ACP1 (0.41) TSHRACP1MAPK1MEN1ALDH1A1
SCHEMBL19986121 0.87 MAPT (0.35) TSHRMAPK1MEN1ALDH1A1KMT2A
SCHEMBL19046775 0.86 ACP1 (0.40) TSHRACP1MAPK1MEN1ALDH1A1
SCHEMBL19986146 0.86 HSD17B10 (0.33) TSHRMEN1KMT2ATP53HSD17B10
SCHEMBL22011574 0.83 ACP1 (0.40) TSHRACP1MAPK1MEN1ALDH1A1
SCHEMBL19986149 0.82 KDM4E (0.37) MAPK1ALDH1A1LMNAUSP2MAPT
SCHEMBL19986103 0.82 ALDH1A1 (0.37) MAPK1MEN1ALDH1A1KMT2ALMNA
SCHEMBL19986122 0.81 MAPT (0.36) TSHRMAPK1MEN1ALDH1A1KMT2A
SCHEMBL19986008 0.81 PLA2G2A (0.35) TSHRMEN1ALDH1A1KMT2ALMNA

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