SCHEMBL28551900

SCHEMBL28551900

CCC(=O)O[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.64
LMNA P02545 1/20 0.64
CYP19A1 P11511 2/20 0.60

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
SCHEMBL14867337 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL27818733 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL1863024 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL17038723 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL17627748 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL19922403 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL309700 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL17035687 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL29361786 1.00 ALDH1A1 (0.64) ALDH1A1LMNACYP19A1
SCHEMBL4713598 0.89 ALDH1A1 (0.66) ALDH1A1LMNACYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115974684-B Chiral borneol ester and synthesis method of chiral borneol 广西壮族自治区林业科学研究院 2024-10-15 CN disclosed
CN-115974684-A Chiral borneol ester and synthesis method of chiral borneol 广西壮族自治区林业科学研究院 2023-04-18 CN disclosed
CN-112920013-B Turpentine synthesized fatty acid borneol ester, preparation method and application thereof in preparation of borneol 广西壮族自治区林业科学研究院 2023-04-07 CN disclosed
CN-113200851-A Method for synthesizing medium-long chain fatty acid fenchyl ester and borneol ester from turpentine and preparing environment-friendly plasticizer 广西壮族自治区林业科学研究院 2021-08-03 CN disclosed
CN-112920013-A Turpentine synthesized fatty acid borneol ester, preparation method and application thereof in preparation of borneol 广西壮族自治区林业科学研究院 2021-06-08 CN disclosed
CN-108250045-B Method for preparing borneol from borneol oxalate 福建南平青松化工有限公司 2021-04-16 CN disclosed