SCHEMBL21896579

SCHEMBL21896579

N#Cc1c(N)c(C#N)c(C#N)c(C#N)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.38
RECQL P46063 1/20 0.38
ALDH1A1 P00352 5/20 0.35
HPGD P15428 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTPN1 P18031 1/20 0.33
KDM4E B2RXH2 3/20 0.32
GAA P10253 3/20 0.32
ALOX15 P16050 3/20 0.32
HSD17B10 Q99714 3/20 0.32
LMNA P02545 1/20 0.32
ALOX12 P18054 1/20 0.32
HTT P42858 1/20 0.32
BPTF Q12830 2/20 0.31
ADORA2A P29274 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
SCHEMBL2896109 0.96 MAPK1 (0.39) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL30102547 0.92 BPTF (0.36) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL24070657 0.92 BPTF (0.36) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL17265815 0.89 BPTF (0.34) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL17265819 0.88 MAPK1 (0.39) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL25778158 0.81 TRPV4 (0.33) MAPK1RECQLALDH1A1
SCHEMBL57168 0.78 ALDH1A1 (0.47) MAPK1ALDH1A1HPGDMAPTMEN1
SCHEMBL18851519 0.77 BPTF (0.36) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL28657820 0.76 MEN1 (0.50) MAPK1RECQLALDH1A1HPGDMAPT
SCHEMBL9154264 0.74 TRPV4 (0.39) MAPK1RECQL

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024126619-A1 ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING A COMPOUND OF FORMULA (I) AND A COMPOUND OF FORMULA (II), AND DISPLAY DEVICE COMPRISING THE ORGANIC ELECTROLUMINESCENT DEVICE NOVALED GMBH (DE) 2024-06-20 WO disclosed
WO-2024061807-A1 ORGANIC ELECTRONIC DEVICE COMPRISING A CHARGE GENERATION LAYER NOVALED GMBH (DE) 2024-03-28 WO disclosed
WO-2024033322-A1 METAL COMPLEX, SEMICONDUCTOR LAYER COMPRISING A METAL COMPLEX AND ORGANIC ELECTRONIC DEVICE NOVALED GMBH (DE) 2024-02-15 WO disclosed
WO-2023110888-A1 A CE(IV) METAL COMPLEX, AN ORGANIC ELECTRONIC DEVICE COMPRISING AN ANODE LAYER, A CATHODE LAYER AND A CHARGE GENERATION LAYER, WHEREIN THE CHARGE GENERATION LAYER COMPRISES A P-TYPE CHARGE GENERATION LAYER THAT COMPRISES THE CE(IV) METAL COMPLEX AND A N-TYPE CHARGE GENERATION LAYER NOVALED GMBH (DE) 2023-06-22 WO disclosed
EP-3109247-B1 CARBAZOLE COMPOUND OR ANALOGUES THEREOF AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO LTD (KR) 2020-04-22 EP disclosed
CN-109081832-A A kind of compound and its application with hole transport performance 瑞声科技(南京)有限公司 2018-12-25 CN disclosed