SCHEMBL7910597

SCHEMBL7910597

O=C=COc1cccc(Cn2nc(C(=O)O)c3c2-c2ccc(OCc4cncnc4)cc2CC3)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ ITGB3 P05106 2/20 0.33
▸ ITGA2B P08514 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ KLF5 Q13887 1/20 0.33
▸ MRGPRX4 Q96LA9 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MAOA P21397 2/20 0.33
▸ MAOB P27338 2/20 0.33
▸ FAAH O00519 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
SCHEMBL7910595 0.89 L3MBTL1 (0.35) ALDH1A1GAAPKML3MBTL1ITGB3
SCHEMBL7916986 0.88 ALDH1A1 (0.46) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7911558 0.88 ALDH1A1 (0.40) ALDH1A1GAAPKML3MBTL1ITGB3
SCHEMBL7903219 0.88 LMNA (0.38) ALDH1A1GAAPKML3MBTL1ITGB3
SCHEMBL7916990 0.87 LMNA (0.41) L3MBTL1ITGB3ITGA2BLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL7911590 0.87 ITGB3 (0.37) L3MBTL1ITGB3ITGA2BLMNASMN1; SMN2
SCHEMBL7911574 0.82 LMNA (0.43) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7910547 0.81 HSD17B10 (0.38) ALDH1A1GAAPKML3MBTL1LMNA
SCHEMBL7911564 0.80 SIRT2 (0.40) LMNASMN1; SMN2NPSR1MAOBKDM4E
SCHEMBL7911545 0.80 CCNA2 (0.38) ALDH1A1LMNASMN1; SMN2NPSR1KMT2A

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
US-6291485-B1 TREATMENT OF POST-PTCA RESTENOSIS TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-09-18 — — US disclosed
EP-1002797-A1 4,5-DIHYDRO- 1H]-BENZ g]INDAZOLE-3-CARBOXYLIC ACID DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2000-05-24 — — EP disclosed
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