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Sugi Predict / Compounds / SCHEMBL29155993

SCHEMBL29155993

SCHEMBL29155993

C1CCC2OC2C1.O=C(O)CCC(=O)OCC1CO1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.61
▸ LMNA P02545 2/20 0.55
▸ TP53 P04637 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ POLB P06746 1/20 0.45
▸ MGLL Q99685 5/20 0.42

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
SCHEMBL29155990 0.94 TP53 (0.54) ALDH1A1LMNATP53CYP3A4POLB
SCHEMBL5500463 0.87 ALDH1A1 (0.67) ALDH1A1LMNAMGLL
SCHEMBL471906 0.80 ALDH1A1 (0.55) ALDH1A1LMNATP53CYP3A4POLB
Adipic Acid SCHEMBL6286734 0.77 MGLL (0.57) ALDH1A1LMNAPOLBMGLL
SCHEMBL1615098 0.77 MGLL (0.57) ALDH1A1LMNAPOLBMGLL
SCHEMBL5067073 0.77 LMNA (0.57) ALDH1A1LMNAPOLBMGLL
SCHEMBL8425153 0.76 ALDH1A1 (1.00) ALDH1A1LMNAPOLBMGLL
SCHEMBL28731110 0.76 TP53 (0.83) ALDH1A1LMNATP53CYP3A4POLB
SCHEMBL3110997 0.76 ALDH1A1 (0.54) ALDH1A1LMNAPOLBMGLL
SCHEMBL7636433 0.76 MGLL (0.58) ALDH1A1LMNAPOLBMGLL

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-117567973-B High Tg underfill and preparation method thereof 深圳先进电子材料国际创新研究院 2024-04-09 — — CN disclosed
CN-117567973-A High Tg underfill and preparation method thereof 深圳先进电子材料国际创新研究院 2024-02-20 — — CN disclosed