SCHEMBL24529319

SCHEMBL24529319

CCNCc1cccc(-c2cc(OC)c3nccn3c2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 6/20 0.40
▸ CD63 P08962 1/20 0.40
▸ HDAC6 Q9UBN7 3/20 0.39
▸ CFD P00746 1/20 0.39
▸ HTR7 P34969 2/20 0.38
▸ PSEN1 P49768 1/20 0.38
▸ PSEN2 P49810 1/20 0.38
▸ APH1B Q8WW43 1/20 0.38
▸ NCSTN Q92542 1/20 0.38
▸ APH1A Q96BI3 1/20 0.38
▸ PSENEN Q9NZ42 1/20 0.38
▸ EPHB4 P54760 5/20 0.37
▸ HTR1A P08908 1/20 0.37
▸ HTR1D P28221 1/20 0.37
▸ HTR1B P28222 1/20 0.37
▸ HTR2A P28223 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ HTR2B P41595 1/20 0.37
▸ HTR5A P47898 1/20 0.37
▸ HTR6 P50406 1/20 0.37

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
SCHEMBL24529207 0.87 HDAC6 (0.37) SYKCD63HDAC6CFDEPHB4
SCHEMBL24529150 0.84 HTR7 (0.45) SYKCD63HDAC6HTR7HTR1A
SCHEMBL24529142 0.81 HCRTR2 (0.46) SYKCD63EPHB4AURKA
SCHEMBL27181434 0.78 SYK (0.39) SYKCD63HDAC6AURKA
SCHEMBL24529318 0.78 SYK (0.39) SYKCD63HDAC6AURKA
SCHEMBL24529535 0.78 DYRK1A (0.47) —
SCHEMBL2897650 0.77 SYK (0.73) SYKCD63
SCHEMBL24529311 0.72 HCRTR2 (0.45) SYKCD63EPHB4AURKA
SCHEMBL24386985 0.72 EPHB4 (0.41) SYKCD63EPHB4AURKA
SCHEMBL27179410 0.72 HCRTR2 (0.54) SYKHDAC6EPHB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022132696-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-23 — — WO disclosed
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