SCHEMBL23569635

SCHEMBL23569635

C/C1=C/c2ccccc2C(=O)N(I)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ CDC25A P30304 2/20 0.38
▸ CDC25B P30305 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ PLIN1 O60240 1/20 0.38
▸ NR1I2 O75469 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ GSR P00390 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HSPD1 P10809 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PKM P14618 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
SCHEMBL23255178 0.88 MEN1 (0.39) MEN1KMT2AALDH1A1CDC25ACDC25B
SCHEMBL21649965 0.81 TTR (0.55) MEN1KMT2AMAPTMAPK1ATM
SCHEMBL23254941 0.75 HTR1A (0.50) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL26224170 0.72 TTR (0.52) ALDH1A1LMNAMAPTHPGDCES1
SCHEMBL7270394 0.71 — —
SCHEMBL487827 0.71 POLB (0.48) MEN1KMT2ACDC25BLMNAPLIN1
SCHEMBL3845335 0.70 CES1 (0.57) ALDH1A1GAAMAOAMAOBCES1
SCHEMBL12459415 0.69 GPR84 (0.54) MEN1KMT2AALDH1A1LMNATP53
SCHEMBL28503423 0.69 POLB (0.46) MEN1KMT2ACDC25BLMNAPLIN1
SCHEMBL678100 0.68 MAPT (0.61) MEN1KMT2AALDH1A1CDC25ACDC25B

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-2021125279-A1 CHEMICALLY CROSSLINKED ALGINATE GEL FIBER 持田製薬株式会社 2021-06-24 — — WO disclosed
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