SCHEMBL25781925

SCHEMBL25781925

O=Cc1ccc(-c2cn3c(=O)c(Cc4ccco4)nc-3c(Cc3ccccc3)[nH]2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 9/20 0.35
▸ ADORA2A P29274 8/20 0.35
▸ ALDH1A1 P00352 7/20 0.34
▸ HSD17B10 Q99714 5/20 0.34
▸ ALOX15 P16050 4/20 0.34
▸ CASP1 P29466 4/20 0.34
▸ USP2 O75604 3/20 0.34
▸ POLB P06746 3/20 0.34
▸ MAPT P10636 3/20 0.34
▸ CASP7 P55210 3/20 0.34
▸ LMNA P02545 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ BLM P54132 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ PKM P14618 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ ALOX12 P18054 1/20 0.34

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
SCHEMBL19810310 0.92 ADORA2B (0.38) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL2670126 0.92 ALDH1A1 (0.39) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL20230357 0.90 ADORA2B (0.34) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL28391210 0.90 PRNP (0.36) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL19810212 0.90 ALDH1A1 (0.38) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL28888591 0.90 PSD (0.38) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL5560844 0.90 ALDH1A1 (0.37) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL19810320 0.90 LTB4R (0.36) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL28394541 0.89 ADORA2B (0.35) ADORA2BADORA2AALDH1A1HSD17B10ALOX15
SCHEMBL20211769 0.88 TSHR (0.36) ADORA2BADORA2AALDH1A1HSD17B10ALOX15

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-3548492-B1 CELL IMPERMEABLE COELENTERAZINE ANALOGUES PROMEGA CORP (US) 2023-07-05 — — EP disclosed
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