SCHEMBL30939925

SCHEMBL30939925

CN(C)CCn1c2cc(O)ccc2c2ccnc(C(F)(F)F)c21

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 6/20 0.52
▸ DYRK2 Q92630 1/20 0.52
▸ DYRK1A Q13627 14/20 0.51
▸ HTR2A P28223 2/20 0.51
▸ HTR2C P28335 2/20 0.51
▸ WEE1 P30291 1/20 0.35

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
SCHEMBL16097994 1.00 HASPIN (0.52) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123508 0.89 HASPIN (0.48) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16126043 0.87 HASPIN (0.48) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123594 0.85 HASPIN (0.53) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939897 0.85 HASPIN (0.53) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939975 0.84 DYRK1A (0.72) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123609 0.84 DYRK1A (0.72) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939988 0.83 DYRK1A (0.71) HASPINDYRK1AHTR2AHTR2C
SCHEMBL16123659 0.83 DYRK1A (0.71) HASPINDYRK1AHTR2AHTR2C
SCHEMBL30939924 0.82 HASPIN (0.45) HASPINDYRK2DYRK1AHTR2AHTR2C

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
CN-113416187-B Alkylamine harmine derivatives for promoting bone growth 奥斯菲治疗有限公司 2024-07-19 — — CN disclosed
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