SCHEMBL28089246

SCHEMBL28089246

O=C(O)c1ccc(C2=C3C=CC(=N3)C=C3C=CC(=N3)C(c3ccc(C(=O)O)cc3)=C3C=CC(=N3)C=C3C=CC2=N3)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 1/20 0.33
▸ BAD Q92934 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ TPMT P51580 1/20 0.33
▸ TOP1 P11387 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ MKNK2 Q9HBH9 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYCS P99999 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ RXRA P19793 2/20 0.31
▸ RXRB P28702 2/20 0.31
▸ SRD5A2 P31213 1/20 0.31
▸ ERN1 O75460 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ CSNK2A1 P68400 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
SCHEMBL28930126 0.99 BCL2L1 (0.33) BCL2L1BADTP53TSHRTPMT
SCHEMBL29163406 0.95 NPC1 (0.38) MKNK1MKNK2NPC1RAB9AKDM4E
SCHEMBL29163495 0.94 NPC1 (0.37) MKNK1MKNK2NPC1RAB9AKDM4E
SCHEMBL1673815 0.92 ALDH1A1 (0.40) NPC1RAB9AKDM4EALDH1A1RXRA
SCHEMBL14246845 0.86 — —
SCHEMBL28232546 0.84 NPC1 (0.34) MKNK1MKNK2NPC1RAB9AKDM4E
SCHEMBL17183610 0.82 TP53 (0.43) BCL2L1BADTP53TSHRTPMT
SCHEMBL21768343 0.82 TP53 (0.43) BCL2L1BADTP53TSHRTPMT
SCHEMBL12076189 0.81 — —
SCHEMBL28459014 0.80 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105802612-A Synthesis method of ratiometric fluorescent probe for detecting oxygen content in living cells 济南大学 2016-07-27 — — CN claimed
CN-105802612-A Synthesis method of ratiometric fluorescent probe for detecting oxygen content in living cells 济南大学 2016-07-27 — — CN disclosed
CN-105802612-A Synthesis method of ratiometric fluorescent probe for detecting oxygen content in living cells 济南大学 2016-07-27 — — CN disclosed
Send feedback