SCHEMBL24027401

SCHEMBL24027401

CNc1cccc(Cc2nc3c(Cc4ccccc4F)[nH]c(-c4ccccc4)cn-3c2=O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ PARP1 P09874 4/20 0.32
▸ GUCY1A1 Q02108 1/20 0.32
▸ GUCY1B1 Q02153 1/20 0.32
▸ PTGER3 P43115 1/20 0.32
▸ GNRHR P30968 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ CASP1 P29466 2/20 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
SCHEMBL24027765 0.90 MAPT (0.37) MAPTALDH1A1SMN1; SMN2PARP1BRD4
SCHEMBL20543577 0.89 THRB (0.38) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL20543509 0.89 GAA (0.37) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL20543625 0.87 GNRHR (0.40) ALDH1A1NPC1RAB9AGNRHRMEN1
SCHEMBL20543506 0.85 GAA (0.37) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL20548364 0.84 GAA (0.35) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL21879026 0.81 NPC1 (0.38) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL20543416 0.80 NPC1 (0.33) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL20543580 0.80 MAPT (0.35) PDE3BPDE3AMAPTALDH1A1NPC1
SCHEMBL19206704 0.80 PARP1 (0.43) ALDH1A1POLBTP53PARP1BRD4

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
EP-3615516-B1 IMIDAZOPYRAZINE DERIVATIVES, PROCESS FOR PREPARATION THEREOF, AND THEIR USES AS LUCIFERINS PASTEUR INSTITUT (FR) 2021-11-17 — — EP disclosed
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