SCHEMBL29628947

SCHEMBL29628947

COC(=O)c1c(C(=O)O)c(C(=O)O)cc2cc3ccccc3cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 5/20 0.50
HPGD P15428 5/20 0.50
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
HSD17B10 Q99714 2/20 0.45
CDC25B P30305 2/20 0.45
CYP1A2 P05177 1/20 0.45
GLA P06280 1/20 0.45
CYP2C19 P33261 1/20 0.45
NPSR1 Q6W5P4 1/20 0.44
IDO1 P14902 1/20 0.42
MAPT P10636 2/20 0.42
GFER P55789 1/20 0.42
NGLY1 Q96IV0 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
PTPN1 P18031 2/20 0.41
MYC P01106 1/20 0.40

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
SCHEMBL7058415 0.88 KDM4E (0.47) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL471867 0.86 KDM4E (0.55) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL27404692 0.84 ALDH1A1 (0.47) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL19253346 0.81 IDO1 (0.50) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL27404691 0.81 KDM4E (0.50) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL22534193 0.80 ALDH1A1 (0.52) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL25189746 0.78 ALDH1A1 (0.50) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL2512793 0.77 KDM4E (0.62) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL29438042 0.77 KDM4E (0.62) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL3679271 0.77 ALDH1A1 (0.51) KDM4EALDH1A1HPGDMEN1KMT2A

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
US-12004510-B2 Pest-resistant irrigation tube DOW GLOBAL TECHNOLOGIES LLC (US) 2024-06-11 US disclosed
US-11361884-B2 Pest-resistant cable jacketing DOW GLOBAL TECHNOLOGIES LLC (US) 2022-06-14 US 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-12004510-B2 Pest-resistant irrigation tube AQP1, AQP3, EXOSC9 KDM4E 2734/4885ALDH1A1 4778/4885HPGD 3671/4885

“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.