SCHEMBL3241758

SCHEMBL3241758

CCOc1cc(Cc2cccc(Cl)c2F)cc2c(=O)c(OC(=O)O)cn([C@@H](CC)CO)c12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 1/20 0.43
▸ TP53 P04637 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ THRB P10828 1/20 0.30
▸ CD274 Q9NZQ7 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
SCHEMBL3245711 0.94 METTL3 (0.42) METTL3TP53RXFP1MRGPRX4ALDH1A1
SCHEMBL3240029 0.93 METTL3 (0.49) METTL3TP53
SCHEMBL3242298 0.91 METTL3 (0.44) METTL3
SCHEMBL3239627 0.91 METTL3 (0.47) METTL3TP53RXFP1MRGPRX4ALDH1A1
SCHEMBL1046023 0.91 METTL3 (0.53) METTL3TP53RXFP1MRGPRX4ALDH1A1
SCHEMBL1046021 0.91 METTL3 (0.53) METTL3TP53RXFP1MRGPRX4ALDH1A1
SCHEMBL3235235 0.90 METTL3 (0.53) METTL3TP53RXFP1MRGPRX4THRB
SCHEMBL3234887 0.89 METTL3 (0.44) METTL3TP53RXFP1MRGPRX4
SCHEMBL3241563 0.87 METTL3 (0.48) METTL3TP53
SCHEMBL3245374 0.86 METTL3 (0.41) METTL3RXFP1ALDH1A1THRBCD274

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-1564210-B9 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2010-03-31 — — EP claimed
EP-1564210-B1 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2009-09-16 — — EP claimed
Send feedback