SCHEMBL29259136

SCHEMBL29259136

C=C(C)C(=O)Oc1ccc(CC(NCC2CO2)C(=O)O)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.40
KMT2A Q03164 2/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ITGB3 P05106 3/20 0.37
ITGA2B P08514 3/20 0.37
ITGA4 P13612 4/20 0.37
ITGB1 P05556 1/20 0.37
ITGB7 P26010 1/20 0.37
PPARG P37231 5/20 0.36
PPARA Q07869 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35

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
Methacrylic Acid SCHEMBL29259138 0.83 FOLH1 (0.43) KMT2AL3MBTL1
SCHEMBL21224186 0.78 MEN1 (0.47) KMT2AL3MBTL1
SCHEMBL9418255 0.77 TGFBR1 (0.48) ELANEKMT2AITGB3ITGA2BITGA4
SCHEMBL29259133 0.77 ALDH1A1 (0.51) ELANEKMT2AATMALDH1A1
SCHEMBL18812870 0.73 SLC7A5 (0.54) ELANEKMT2AATMALDH1A1ITGB3
SCHEMBL345967 0.73 SLC7A5 (0.54) ELANEKMT2AATMALDH1A1ITGB3
SCHEMBL21373902 0.72 ALDH1A1 (0.50) ELANEKMT2AATMALDH1A1PPARG
SCHEMBL24709164 0.72 ALDH1A1 (0.55) ELANEKMT2AATMALDH1A1PPARG
SCHEMBL4596032 0.71 ELANE (0.51) ELANEKMT2AATM
Glycidol SCHEMBL27968005 0.71 ELANE (0.52) ELANEKMT2AATMALDH1A1

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-118184910-B Preparation method and application of modified spherical nano aluminum oxide 山东金微纳米科技有限公司 2025-02-11 CN claimed
CN-118184910-A Preparation method and application of modified spherical nano aluminum oxide 山东金微纳米科技有限公司 2024-06-14 CN claimed
CN-118184910-B Preparation method and application of modified spherical nano aluminum oxide 山东金微纳米科技有限公司 2025-02-11 CN disclosed
CN-118184910-A Preparation method and application of modified spherical nano aluminum oxide 山东金微纳米科技有限公司 2024-06-14 CN disclosed