SCHEMBL31373262

SCHEMBL31373262

O=C(Nc1cnc2c(-c3cc(Cl)ccc3F)c(F)ccc2c1N1CCOCC1)c1ccnc2ccccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 5/20 0.48
▸ TP53 P04637 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ F10 P00742 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ GPR55 Q9Y2T6 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL31373274 0.94 BCHE (0.46) BCHETP53THRBMEN1KMT2A
SCHEMBL31373298 0.93 TP53 (0.46) BCHETP53THRBALDH1A1USP2
SCHEMBL31373267 0.92 BCHE (0.42) BCHETP53THRBALDH1A1USP2
SCHEMBL31373273 0.92 BCHE (0.44) BCHETP53THRBMEN1KMT2A
SCHEMBL31373279 0.92 BCHE (0.45) BCHETP53THRBALDH1A1USP2
SCHEMBL31373258 0.91 BCHE (0.46) BCHETP53THRBMEN1KMT2A
SCHEMBL31373265 0.90 GAA (0.46) BCHETP53THRBMEN1KMT2A
SCHEMBL31373276 0.90 TP53 (0.49) BCHETP53THRBNPC1ALDH1A1
SCHEMBL31373268 0.90 BCHE (0.42) BCHETP53THRBNPC1ALDH1A1
SCHEMBL31373242 0.89 BCHE (0.44) BCHETP53THRBNPC1ALDH1A1

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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