SCHEMBL24027765

SCHEMBL24027765

CNc1cccc(Cc2nc3c(Cc4ccccc4)[nH]c(-c4ccccc4)cn-3c2=O)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.37
▸ BRD4 O60885 1/20 0.35
▸ PARP1 P09874 6/20 0.35
▸ CDC7 O00311 1/20 0.34
▸ LTB4R Q15722 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ CASP1 P29466 2/20 0.33
▸ CYP2C19 P33261 2/20 0.33
▸ CASP7 P55210 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ALKBH3 Q96Q83 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ HIF1A Q16665 1/20 0.33

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
SCHEMBL24027401 0.90 PDE3B (0.35) MAPTBRD4PARP1ALDH1A1MEN1
SCHEMBL19206704 0.90 PARP1 (0.43) BRD4PARP1ALDH1A1MEN1CYP1A2
SCHEMBL19206673 0.89 MAPT (0.41) MAPTPARP1CDC7ALDH1A1KDM4E
SCHEMBL492636 0.88 LTB4R (0.41) MAPTPARP1CDC7LTB4RALDH1A1
SCHEMBL20543611 0.88 THRB (0.42) MAPTCDC7ALDH1A1MEN1KMT2A
SCHEMBL19206676 0.87 LTB4R (0.38) MAPTCDC7LTB4RALDH1A1HSD17B10
SCHEMBL19206672 0.87 CDC7 (0.38) MAPTCDC7LTB4RALDH1A1HSD17B10
SCHEMBL19206693 0.86 POLB (0.38) CDC7LTB4RALDH1A1KMT2AHSD17B10
SCHEMBL19206663 0.86 NMT1 (0.38) PARP1CDC7LTB4RALKBH3PSD
SCHEMBL20543423 0.86 PDE3B (0.38) MAPTCDC7LTB4RALDH1A1CYP1A2

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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