SCHEMBL24417237

SCHEMBL24417237

c1ccc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4-n4c5ccccc5c5ccc6oc7c(-c8ccccc8)cccc7c6c54)n3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 5/20 0.33
PIK3CD O00329 3/20 0.32
PIK3CA P42336 3/20 0.32
PIK3CB P42338 3/20 0.32
PIK3CG P48736 3/20 0.32
MAPK14 Q16539 1/20 0.31
ALDH1A1 P00352 3/20 0.30
KDM4E B2RXH2 2/20 0.30
BRD4 O60885 2/20 0.30
BRD2 P25440 2/20 0.30
BRD3 Q15059 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
PDE2A O00408 1/20 0.30
PIK3C2A O00443 1/20 0.30
PIK3R2 O00459 1/20 0.30
PIK3C2B O00750 1/20 0.30
PDE5A O76074 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL24417240 0.99 PRKDC (0.32) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417285 0.96 PRKDC (0.35) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417239 0.96 PRKDC (0.32) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417236 0.95 PRKDC (0.33) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417238 0.95 PRKDC (0.33) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417284 0.95 PRKDC (0.33) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417323 0.93 PRKDC (0.31) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL24417322 0.92 PRKDC (0.38) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL27445343 0.91 KDM4E (0.33) PRKDCPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL25660286 0.91 PLA2G2A (0.32) PRKDCMAPK14ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220149289-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2022-05-12 US disclosed