SCHEMBL7913431

SCHEMBL7913431

COC(=O)c1nn(Cc2ccccc2)c2c1CCc1cc(OCc3ccccc3)ccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ LMNA P02545 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAOA P21397 2/20 0.44
▸ MAOB P27338 2/20 0.44
▸ FAAH O00519 3/20 0.42
▸ MAPT P10636 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ S1PR1 P21453 2/20 0.41
▸ PRKX P51817 1/20 0.41
▸ ACVR1 Q04771 1/20 0.41
▸ S1PR5 Q9H228 1/20 0.41
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.41
▸ CCNA2 P20248 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCNA1 P78396 1/20 0.41

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
SCHEMBL7903245 0.93 SMN1; SMN2 (0.44) SMN1; SMN2LMNANPSR1MAOAMAOB
SCHEMBL7911579 0.88 SMN1; SMN2 (0.46) SMN1; SMN2LMNANPSR1MAPTALDH1A1
SCHEMBL7911574 0.85 LMNA (0.43) SMN1; SMN2LMNANPSR1FAAHMAPT
SCHEMBL7910547 0.84 HSD17B10 (0.38) SMN1; SMN2LMNANPSR1FAAHMAPT
SCHEMBL7916990 0.83 LMNA (0.41) SMN1; SMN2LMNANPSR1MAOAMAOB
SCHEMBL7911545 0.83 CCNA2 (0.38) SMN1; SMN2LMNANPSR1FAAHMAPT
SCHEMBL7913265 0.79 SIRT2 (0.39) SMN1; SMN2LMNANPSR1MAOBMAPT
SCHEMBL7916986 0.79 ALDH1A1 (0.46) SMN1; SMN2LMNANPSR1FAAHMAPT
SCHEMBL7911558 0.78 ALDH1A1 (0.40) SMN1; SMN2LMNANPSR1MAOAMAOB
SCHEMBL7903219 0.77 LMNA (0.38) SMN1; SMN2LMNANPSR1MAOAMAOB

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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