SCHEMBL9574173

SCHEMBL9574173

COC(=O)c1cc(C(=O)CN(CCCCCCOCCCc2ccccc2)Cc2ccccc2)ccc1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.43
▸ APP P05067 3/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ EGFR P00533 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ ACHE P22303 1/20 0.38

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
SCHEMBL10076826 0.98 MAOB (0.43) MAOBAPPMEN1LMNAKMT2A
Hydrochloric Acid SCHEMBL11671567 0.90 APP (0.47) MAOBAPPMEN1LMNAKMT2A
SCHEMBL10592068 0.83 MAOB (0.40) MAOBAPPMEN1KMT2ABCHE
SCHEMBL10477860 0.81 KDM4E (0.41) MAOBMEN1LMNAKMT2ABCHE
SCHEMBL9668333 0.81 MAOB (0.42) MAOBAPPMEN1KMT2ABCHE
SCHEMBL10077369 0.81 CDK1 (0.42) MAOBMEN1KMT2ABCHEACHE
SCHEMBL456296 0.78 FOLH1 (0.43) MAOBEGFR
SCHEMBL11750936 0.78 SMN1; SMN2 (0.47) MAOBMEN1LMNAKMT2AEGFR
SCHEMBL9763320 0.76 KDM4E (0.40) MEN1KMT2A
SCHEMBL10488546 0.75 RAF1 (0.38) MAOBMEN1KMT2ABCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5243076-A Adrenergic stimulant intermediates GLAXO GROUP LTD. 1993-09-07 — — US disclosed
US-5225445-A Respiratory system disorders GLAXO GROUP LTD. 1993-07-06 — — US disclosed
US-5126375-A Asthma, chronic bronchitis GLAXO GROUP LTD. (GB) 1992-06-30 — — US disclosed
US-5091422-A Treating inflammatory or allergic skin disease, lowering gastric acidity GLAXO GROUP LIMITED (GB) 1992-02-25 — — US disclosed
US-4992474-A Adrenergic stimulants GLAXO GROUP LTD. (GB) 1991-02-12 — — US disclosed
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