SCHEMBL29010477

SCHEMBL29010477

C=Cc1cc(I)c(I)c(I)c1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.40
▸ TSHR P16473 1/20 0.35
▸ TPMT P51580 1/20 0.35
▸ TP53 P04637 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL21045991 0.78 TTR (0.50) ALDH1A1TSHRTP53TDP1
SCHEMBL31080054 0.78 CA1 (0.39) ALDH1A1TSHRTP53TDP1
SCHEMBL217938 0.73 ALDH1A1 (0.57) ALDH1A1TSHRTP53TDP1
SCHEMBL16953148 0.73 ALDH1A1 (0.42) ALDH1A1TSHRTP53TDP1
SCHEMBL16960433 0.73 ALDH1A1 (0.42) ALDH1A1TSHRTP53TDP1
SCHEMBL22991515 0.72 TTR (0.39) ALDH1A1TSHRTP53TDP1
SCHEMBL18677460 0.72 TP53 (0.35) ALDH1A1TP53TDP1
SCHEMBL22991411 0.72 ACE (0.50) ALDH1A1TSHRTP53TDP1
SCHEMBL22288129 0.72 ALDH1A1 (0.50) ALDH1A1TSHRTP53TDP1
SCHEMBL22991663 0.71 TTR (0.42) —

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116041610-B Polymer enzyme activator and preparation method thereof 苏州麦斯达尔医疗科技有限公司 2024-04-16 — — CN claimed
CN-116041610-A Polymer enzyme activator and preparation method thereof 苏州麦斯达尔医疗科技有限公司 2023-05-02 — — CN claimed
CN-116041610-B Polymer enzyme activator and preparation method thereof 苏州麦斯达尔医疗科技有限公司 2024-04-16 — — CN disclosed
CN-116041610-A Polymer enzyme activator and preparation method thereof 苏州麦斯达尔医疗科技有限公司 2023-05-02 — — CN disclosed
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