SCHEMBL26101680

SCHEMBL26101680

C=CC(CC[Si](OC)(OC)OC)Nc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.35
▸ KCNH3 Q9ULD8 2/20 0.34
▸ ALDH1A1 P00352 6/20 0.33
▸ MEN1 O00255 4/20 0.32
▸ KMT2A Q03164 4/20 0.32
▸ GAA P10253 1/20 0.32
▸ LMNA P02545 4/20 0.32
▸ ALOX12 P18054 3/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ THRB P10828 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ HTT P42858 2/20 0.32
▸ MAPK1 P28482 2/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ POLB P06746 2/20 0.31

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
SCHEMBL26100818 0.85 TDP1 (0.33) TDP1KCNH3ALDH1A1GAALMNA
SCHEMBL26104985 0.79 SMN1; SMN2 (0.40) TDP1ALDH1A1GAATSHRL3MBTL1
SCHEMBL1261746 0.78 G6PD (0.46) TDP1KCNH3ALDH1A1MEN1KMT2A
SCHEMBL5430418 0.77 TDP1 (0.42) TDP1KCNH3ALDH1A1MEN1KMT2A
SCHEMBL21806056 0.76 TDP1 (0.38) TDP1KCNH3ALDH1A1MEN1KMT2A
SCHEMBL28882717 0.75 ALDH1A1 (0.36) TDP1ALDH1A1MEN1KMT2AGAA
SCHEMBL20239078 0.74 MEN1 (0.42) TDP1MEN1KMT2AGAAATM
SCHEMBL5130052 0.73 ALDH1A1 (0.35) TDP1KCNH3ALDH1A1MEN1KMT2A
SCHEMBL515294 0.71 CYP2D6 (0.37) ALDH1A1MEN1KMT2A
SCHEMBL20872336 0.71 KCNH2 (0.36) KCNH3ALDH1A1HTT

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
WO-2023072128-A1 COLORANT COMPOSITION AND COATED ARTICLE GUANGDONG HUARUN PAINTS CO., LTD. (CN) 2023-05-04 — — WO claimed
WO-2023072128-A1 COLORANT COMPOSITION AND COATED ARTICLE GUANGDONG HUARUN PAINTS CO., LTD. (CN) 2023-05-04 — — WO disclosed
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