SCHEMBL31373303

SCHEMBL31373303

O=C(Nc1cnc2c(-c3cccc(F)c3F)c(F)ccc2c1N1CCOCC1)c1ccnc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 6/20 0.41
▸ USP2 O75604 1/20 0.39
▸ PIM2 Q9P1W9 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GPR55 Q9Y2T6 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ NR4A1 P22736 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ UBE2I P63279 1/20 0.38
▸ CACNA1B Q00975 1/20 0.38
▸ APBA1 Q02410 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ SAE1 Q9UBE0 1/20 0.38
▸ UBA2 Q9UBT2 1/20 0.38

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
SCHEMBL31373242 0.93 BCHE (0.44) BCHEUSP2TP53THRBKDM4E
SCHEMBL31373285 0.93 BCHE (0.42) BCHEUSP2TP53THRBCNR2
SCHEMBL31373268 0.92 BCHE (0.42) BCHEUSP2PIM2TP53THRB
SCHEMBL31373297 0.92 BCHE (0.47) BCHEUSP2PIM2TP53THRB
SCHEMBL31373291 0.92 BCHE (0.46) BCHEUSP2TP53MAPTKDM4E
SCHEMBL31373264 0.91 TP53 (0.41) BCHEUSP2TP53THRBMAPT
SCHEMBL31373253 0.90 BCHE (0.44) BCHETP53THRBCNR2KDM4E
SCHEMBL31373267 0.90 BCHE (0.42) BCHEUSP2TP53THRBMAPT
SCHEMBL31373298 0.89 TP53 (0.46) BCHEUSP2TP53THRBMAPT
SCHEMBL31373254 0.89 BCHE (0.43) BCHEUSP2TP53THRBCNR2

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
WO-2025027117-A1 CARBOXAMIDE-4-QUINOLINE COMPOUNDS WITH ANTHELMINTIC ACTIVITY INTERVET INTERNATIONAL B.V. (NL) 2025-02-06 — — WO disclosed
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