SCHEMBL28618274

SCHEMBL28618274

[O-]/[N+](=C\c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ G6PD P11413 3/20 0.85
▸ ALDH1A1 P00352 12/20 0.67
▸ MAPT P10636 10/20 0.67
▸ ALOX15 P16050 2/20 0.67
▸ TSHR P16473 1/20 0.67
▸ RECQL P46063 1/20 0.67
▸ NPC1 O15118 5/20 0.62
▸ RAB9A P51151 5/20 0.62
▸ HSD17B10 Q99714 2/20 0.62
▸ HPGD P15428 2/20 0.62
▸ MAPK1 P28482 2/20 0.56
▸ NPSR1 Q6W5P4 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.39
▸ GAA P10253 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 1/20 0.35

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
SCHEMBL11413895 1.00 G6PD (0.85) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL2242956 0.92 G6PD (1.00) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL12355277 0.92 G6PD (1.00) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL12349141 0.90 G6PD (0.81) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL19875637 0.89 ALDH1A1 (0.80) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL12349218 0.85 ALDH1A1 (0.73) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL264278 0.85 ALDH1A1 (0.73) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL264277 0.85 ALDH1A1 (0.73) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL11403099 0.81 ALDH1A1 (0.69) G6PDALDH1A1MAPTALOX15TSHR
SCHEMBL12416931 0.80 G6PD (0.85) G6PDALDH1A1MAPTALOX15TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113214252-B Synthesis method of 6-phenyl-7- (pyridine-2-yl) -7H-indolo [2,3-c ] quinoline compound 常州大学 2022-02-11 — — CN disclosed
CN-113214252-A Synthesis method of 6-phenyl-7- (pyridine-2-yl) -7H-indolo [2,3-c ] quinoline compound 常州大学 2021-08-06 — — CN disclosed
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