SCHEMBL30939897

SCHEMBL30939897

CCN(CC)CCCn1c2cc(O)ccc2c2ccnc(C(F)(F)F)c21

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 7/20 0.53
▸ DYRK2 Q92630 1/20 0.53
▸ KIT P10721 1/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ FGFR3 P22607 1/20 0.42
▸ DYRK1A Q13627 10/20 0.41
▸ NQO2 P16083 1/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ NSD2 O96028 1/20 0.36
▸ SMARCA2 P51531 1/20 0.36
▸ ABCB1 P08183 1/20 0.36

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
SCHEMBL16123594 1.00 HASPIN (0.53) HASPINDYRK2KITPDGFRAFGFR3
SCHEMBL16123595 0.86 HASPIN (0.73) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL30939902 0.85 DYRK1A (0.55) HASPINDYRK1AHTR2AHTR2C
SCHEMBL30939925 0.85 HASPIN (0.52) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16123596 0.85 DYRK1A (0.55) HASPINDYRK1AHTR2AHTR2C
SCHEMBL16097994 0.85 HASPIN (0.52) HASPINDYRK2DYRK1AHTR2AHTR2C
SCHEMBL16126043 0.83 HASPIN (0.48) HASPINDYRK2KITPDGFRAFGFR3
SCHEMBL15227864 0.83 HASPIN (0.72) HASPINDYRK2DYRK1A
SCHEMBL30939871 0.83 HASPIN (0.72) HASPINDYRK2DYRK1A
SCHEMBL16123508 0.81 HASPIN (0.48) 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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