SCHEMBL29036705

SCHEMBL29036705

CC[AlH2].O=[PH](O)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ CES2 O00748 2/20 0.34
▸ CES1 P23141 2/20 0.34
▸ TP53 P04637 1/20 0.33
▸ PGR P06401 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ ADRA2B P18089 1/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ PSIP1 O75475 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 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
Alcohol SCHEMBL28175078 0.88 TSHR (0.39) ALDH1A1TSHRGLACES2CES1
Butane SCHEMBL1966868 0.88 TSHR (0.39) ALDH1A1TSHRGLACES2CES1
SCHEMBL28009748 0.88 TSHR (0.32) ALDH1A1TSHRGLACES2CES1
Ethylamine SCHEMBL11203396 0.86 ALDH1A1 (0.38) ALDH1A1TSHRGLACES2CES1
Ethane SCHEMBL28571246 0.85 TSHR (0.33) ALDH1A1TSHRGLACES2CES1
SCHEMBL36107 0.85 — —
Propionic Acid SCHEMBL7092961 0.84 FFAR3 (0.43) ALDH1A1TSHRGLACES2CES1
SCHEMBL11054168 0.83 NPSR1 (0.33) ALDH1A1TSHRGLACES2CES1
SCHEMBL23780657 0.83 TSHR (0.38) ALDH1A1TSHRGLACES2CES1
Ammonia Solution, Strong SCHEMBL9441939 0.83 TSHR (0.35) ALDH1A1TSHRGLACES2CES1

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
CN-115216142-B Antistatic halogen-free flame-retardant reinforced nylon composite material and preparation method thereof 横店集团得邦工程塑料有限公司 2023-07-18 — — CN claimed
CN-115304913-B Reinforced flame-retardant hypophosphite/nylon composite material with high glow wire ignition temperature and preparation method thereof 横店集团得邦工程塑料有限公司 2023-07-18 — — CN disclosed
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