SCHEMBL25316239

SCHEMBL25316239

N#Cc1ccc(C=Nc2cccc(-c3c(C(=O)O)cccc3C(=O)O)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.41
▸ HTT P42858 3/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ XDH P47989 1/20 0.40
▸ SLC22A12 Q96S37 1/20 0.40
▸ TUBB4A P04350 1/20 0.38
▸ TUBB P07437 1/20 0.38
▸ TUBA3C P0DPH7 1/20 0.38
▸ TUBA1B P68363 1/20 0.38
▸ TUBA4A P68366 1/20 0.38
▸ TUBB4B P68371 1/20 0.38
▸ TUBB3 Q13509 1/20 0.38
▸ TUBB2A Q13885 1/20 0.38
▸ TUBB8 Q3ZCM7 1/20 0.38
▸ TUBA3E Q6PEY2 1/20 0.38
▸ TUBA1A Q71U36 1/20 0.38
▸ TUBA1C Q9BQE3 1/20 0.38
▸ TUBB6 Q9BUF5 1/20 0.38
▸ TUBB2B Q9BVA1 1/20 0.38
▸ TUBB1 Q9H4B7 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
SCHEMBL25316234 1.00 ALDH1A1 (0.41) ALDH1A1HTTSMN1; SMN2XDHSLC22A12
SCHEMBL30343496 0.86 PTGS2 (0.43) ALDH1A1HTTSMN1; SMN2TUBB4ATUBB
SCHEMBL25313886 0.86 CA2 (0.50) ALDH1A1SMN1; SMN2CA2CA1CA7
SCHEMBL25313881 0.86 CA2 (0.50) ALDH1A1SMN1; SMN2CA2CA1CA7
SCHEMBL28610748 0.73 ALDH1A1 (0.53) ALDH1A1HTTSMN1; SMN2CA2CA1
SCHEMBL11656373 0.73 ALDH1A1 (0.53) ALDH1A1HTTSMN1; SMN2CA2CA1
SCHEMBL11656369 0.73 ALDH1A1 (0.53) ALDH1A1HTTSMN1; SMN2CA2CA1
SCHEMBL30343495 0.72 CA1 (0.56) ALDH1A1HTTSMN1; SMN2CA2CA1
SCHEMBL9649909 0.72 CA2 (0.67) ALDH1A1CA2CA1LMNAMAPT
SCHEMBL6364078 0.72 CA2 (0.67) ALDH1A1CA2CA1LMNAMAPT

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
US-20230235116-A1 HIGH-TEMPERATURE SELF-CROSSLINKING-BASED FLAME-RETARDANT ANTI-DRIPPING COPOLYESTER, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SICHUAN UNIVERSITY (CN) 2023-07-27 — — US disclosed
EP-4169967-A1 HIGH-TEMPERATURE SELF-CROSSLINKING-BASED FLAME-RETARDANT DROPLET-RESISTANT COPOLYESTER, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Sichuan University (CN) 2023-04-26 — — EP disclosed
CN-113817152-B Flame-retardant anti-dripping copolyester based on high-temperature self-crosslinking and preparation method and application thereof 四川大学 2022-11-11 — — CN disclosed
CN-113817152-A Flame-retardant anti-dripping copolyester based on high-temperature self-crosslinking and preparation method and application thereof 四川大学 2021-12-21 — — CN disclosed
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