SCHEMBL24945261

SCHEMBL24945261

c1ccc(-c2ccccc2-c2cccc(-c3ccc(N(c4ccc(-c5cccc6cccc(-c7ccccc7)c56)cc4)c4cccc5c4oc4c(-c6ccccc6)cccc45)cc3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 13/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 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
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ BRD4 O60885 2/20 0.32
▸ BRD2 P25440 2/20 0.32
▸ BRD3 Q15059 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ PIK3C2A O00443 1/20 0.32
▸ PIK3R2 O00459 1/20 0.32
▸ PIK3C2B O00750 1/20 0.32

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
SCHEMBL24944602 1.00 PRKDC (0.36) PRKDCALOX5CA12CA1CA2
SCHEMBL24945255 0.95 PRKDC (0.33) PRKDCALOX5CA12CA1CA2
SCHEMBL24945254 0.93 ALDH1A1 (0.34) PRKDCALOX5PIK3CDPIK3CAPIK3CB
SCHEMBL24945283 0.92 CYP1A1 (0.37) PRKDCCA12CA1CA2CA9
SCHEMBL24945281 0.92 CYP1A1 (0.37) PRKDCCA12CA1CA2CA9
SCHEMBL24945265 0.91 ALOX5 (0.42) PRKDCALOX5CA12CA1CA2
SCHEMBL24945268 0.91 ALOX5 (0.42) PRKDCALOX5CA12CA1CA2
SCHEMBL18371363 0.91 CA12 (0.41) PRKDCALOX5CA12CA1CA2
SCHEMBL22837460 0.89 MCL1 (0.37) PRKDCALOX5CA12CA1CA2
SCHEMBL24901200 0.89 PRKDC (0.39) PRKDCALOX5PIK3CDPIK3CAPIK3CB

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-20230013038-A1 LIGHT EMITTING DEVICE AND AMINE COMPOUND FOR LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-01-19 — — US disclosed
Send feedback