SCHEMBL27939719

SCHEMBL27939719

CCn1c2cc(OC(C)C)ccc2c2ccnc(C)c21

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 17/20 0.75
▸ ACHE P22303 1/20 0.56
▸ MAOA P21397 1/20 0.56
▸ HASPIN Q8TF76 3/20 0.55
▸ HTR2A P28223 1/20 0.55
▸ HTR2C P28335 1/20 0.55

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
SCHEMBL27917640 0.88 DYRK1A (0.77) DYRK1AHASPIN
SCHEMBL17502377 0.88 DYRK1A (0.67) DYRK1AHASPIN
SCHEMBL17502380 0.88 DYRK1A (0.67) DYRK1AHASPIN
SCHEMBL27939882 0.86 DYRK1A (0.73) DYRK1AACHEMAOAHASPINHTR2A
SCHEMBL17102949 0.86 DYRK1A (0.71) DYRK1AHASPIN
SCHEMBL17102942 0.86 DYRK1A (0.71) DYRK1AHASPIN
SCHEMBL668477 0.86 DYRK1A (1.00) DYRK1AACHEMAOAHASPINHTR2A
SCHEMBL17517500 0.85 DYRK1A (0.62) DYRK1AHASPIN
SCHEMBL17517498 0.84 DYRK1A (0.62) DYRK1AHASPIN
SCHEMBL17517501 0.84 DYRK1A (0.62) DYRK1AHASPIN

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-101429198-B Banisterine derivant and uses thereof XINJIANG HUASHIDAN MEDICAMENTS RES CO LTD 2013-10-23 — — CN disclosed
CN-103070862-A Application of harmine derivative in preparation of antibacterial drugs XINJIANG HUASHIDAN PHARMACEUTICAL RES CO LTD 2013-05-01 — — CN disclosed
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