SCHEMBL20172096

SCHEMBL20172096

Sc1cncc2cccnc12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 4/20 0.61
COPS5 Q92905 4/20 0.61
CCR1 P32246 5/20 0.48
CCR8 P51685 5/20 0.48
LMNA P02545 3/20 0.48
CCR5 P51681 3/20 0.48
KDM4E B2RXH2 3/20 0.48
MMP2 P08253 2/20 0.48
TSHR P16473 2/20 0.48
HSP90AA1 P07900 2/20 0.48
GMNN O75496 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
MAPT P10636 1/20 0.48
MMP9 P14780 1/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
MMP8 P22894 1/20 0.48
THPO P40225 1/20 0.48

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
SCHEMBL536578 0.76 PSMD14 (1.00) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL30079755 0.76 PSMD14 (1.00) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL18583712 0.75 LMNA (0.48) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL10134475 0.75 CCR1 (0.52) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL2008991 0.75 CCR1 (0.48) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL31509775 0.75 LMNA (0.48) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL12747782 0.75 KDM4E (0.48) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL20172095 0.75 HSP90AA1 (0.48) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL277027 0.75 MMP2 (0.61) PSMD14COPS5CCR1CCR8LMNA
SCHEMBL112474 0.75 LMNA (0.48) PSMD14COPS5CCR1CCR8LMNA

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
EP-3339395-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2019-10-02 EP disclosed
EP-2980182-B1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2018-05-23 EP disclosed