SCHEMBL31364709

SCHEMBL31364709

OB(O)c1ccccc1-c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.52
ABCB1 P08183 2/20 0.52
BCR P11274 2/20 0.52
ESR2 Q92731 4/20 0.47
BCL2L1 Q07817 2/20 0.46
MMP3 P08254 1/20 0.46
ESR1 P03372 4/20 0.42
ENPP2 Q13822 2/20 0.41
PTPN1 P18031 1/20 0.39
BACE1 P56817 1/20 0.39
ALOX5 P09917 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL29825386 0.84 MGLL (0.54) BCL2L1MMP3ENPP2BACE1ALDH1A1
SCHEMBL4145743 0.84 MGLL (0.54) BCL2L1MMP3ENPP2BACE1ALDH1A1
Benzene SCHEMBL28163950 0.84 ALDH1A1 (0.48) BCL2L1ENPP2BACE1ALDH1A1HPGD
SCHEMBL21933 0.84 ALDH1A1 (0.48) BCL2L1ENPP2BACE1ALDH1A1HPGD
SCHEMBL29838597 0.84 ALDH1A1 (0.48) BCL2L1ENPP2BACE1ALDH1A1HPGD
SCHEMBL1853561 0.83 CA2 (0.44) ENPP2ALDH1A1HPGDMEN1KMT2A
Methyl Alcohol SCHEMBL28631854 0.82 ALDH1A1 (0.46) BCL2L1ENPP2BACE1ALDH1A1HPGD
Water SCHEMBL29954878 0.82 ALDH1A1 (0.46) BCL2L1ENPP2BACE1ALDH1A1HPGD
SCHEMBL28326904 0.82 ALDH1A1 (0.46) BCL2L1ENPP2BACE1ALDH1A1HPGD
SCHEMBL29071227 0.81 ESR2 (0.64) ABL1ABCB1BCRESR2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122029157-A Bilobalide derivatives for the treatment of neurological diseases and cancers 香港中文大学 2026-05-12 CN disclosed
US-20250144069-A1 BILOBALIDE DERIVATIVE COMPOUNDS FOR TREATING NEUROLOGICAL DISEASES AND CANCERS THE CHINESE UNIVERSITY OF HONG KONG (CN) 2025-05-08 US disclosed
WO-2025031304-A1 BILOBALIDE DERIVATIVE COMPOUNDS FOR TREATING NEUROLOGICAL DISEASES AND CANCERS THE CHINESE UNIVERSITY OF HONG KONG (CN) 2025-02-13 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250144069-A1 BILOBALIDE DERIVATIVE COMPOUNDS FOR TREATING NEUROLOGICAL DISEASES AND CANCERS BTD, BCHE, BRCA1 ABL1 3329/4885ABCB1 48/4885BCR 3097/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.