SCHEMBL26100818

SCHEMBL26100818

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

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.31
▸ KCNH3 Q9ULD8 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ ALOX12 P18054 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL26101680 0.85 TDP1 (0.35) TDP1NPSR1KCNH3GAAALDH1A1
SCHEMBL26100773 0.81 SMN1; SMN2 (0.38) NPSR1ALDH1A1CYP3A4TSHRATM
SCHEMBL1261812 0.79 ALDH1A1 (0.42) TDP1NPSR1KCNH3GAAALDH1A1
SCHEMBL5430418 0.78 TDP1 (0.42) TDP1KCNH3GAAALDH1A1LMNA
SCHEMBL27923953 0.70 HRH1 (0.42) NPSR1ALDH1A1LMNACYP3A4ALOX15
SCHEMBL15816497 0.70 CYP2C19 (0.37) ALDH1A1LMNAALOX15HSD17B10
SCHEMBL27245488 0.69 ALDH1A1 (0.45) TDP1NPSR1KCNH3GAAALDH1A1
SCHEMBL25220244 0.69 MAPT (0.37) NPSR1ALDH1A1CYP3A4L3MBTL1
SCHEMBL554774 0.68 MAPT (0.47) NPSR1KCNH3GAAALDH1A1L3MBTL1
Diphenylamine SCHEMBL28715243 0.68 HSD17B10 (0.44) TDP1NPSR1KCNH3GAAALDH1A1

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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