SCHEMBL19986108

SCHEMBL19986108

c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c4ccccc4n3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 2/20 0.40
TSHR P16473 5/20 0.40
ABCG2 Q9UNQ0 1/20 0.39
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 5/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.35
ACHE P22303 1/20 0.35
USP2 O75604 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL19986107 0.98 ACP1 (0.41) ACP1TSHRABCG2MAPK1HSD17B10
SCHEMBL19986111 0.93 TSHR (0.36) ACP1TSHRABCG2MAPK1HSD17B10
SCHEMBL19986120 0.87 MAPT (0.38) TSHRMAPK1HSD17B10LMNAMAPT
SCHEMBL22011574 0.85 ACP1 (0.40) ACP1TSHRABCG2MAPK1HSD17B10
SCHEMBL19046767 0.85 ACP1 (0.46) ACP1TSHRABCG2MAPK1HSD17B10
SCHEMBL19986144 0.85 HSD17B10 (0.37) HSD17B10LMNAMAPTKDM4EMEN1
SCHEMBL19986118 0.84 MAPT (0.39) TSHRMAPK1HSD17B10LMNAMAPT
SCHEMBL19988558 0.84 ALDH1A1 (0.40) ACP1TSHRMAPK1HSD17B10LMNA
SCHEMBL19046778 0.83 ACP1 (0.48) ACP1TSHRABCG2MAPK1HSD17B10
SCHEMBL19986204 0.83 HSD17B10 (0.38) TSHRHSD17B10MAPTKDM4EMEN1

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