SCHEMBL2467709

SCHEMBL2467709

O=C(O)c1cccc(Cc2cccc(Cc3ccccc3O)c2O)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGB1 P09429 3/20 0.56
HSPA5 P11021 1/20 0.55
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 2/20 0.52
HPGD P15428 2/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA7 P43166 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CA9 Q16790 1/20 0.52
NAPRT Q6XQN6 1/20 0.52
CA14 Q9ULX7 1/20 0.52
PTPN1 P18031 3/20 0.50
PTPN2 P17706 2/20 0.50
PTPN6 P29350 2/20 0.50
AKR1B1 P15121 1/20 0.48
CXCL12 P48061 1/20 0.47

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
SCHEMBL1161183 0.98 HMGB1 (0.57) HMGB1HSPA5ALDH1A1KDM4EHPGD
SCHEMBL7992930 0.90 HPGD (0.60) HMGB1HSPA5ALDH1A1KDM4EHPGD
SCHEMBL29697016 0.89 HMGB1 (0.67) HMGB1ALDH1A1KDM4EHPGDCA12
SCHEMBL633197 0.89 HMGB1 (0.67) HMGB1ALDH1A1KDM4EHPGDCA12
SCHEMBL4731949 0.85 HSPA5 (0.64) HMGB1HSPA5ALDH1A1KDM4EHPGD
Salicylic Acid SCHEMBL29700476 0.83 KDM4E (0.58) HMGB1ALDH1A1KDM4EHPGDCA12
SCHEMBL5852506 0.83 HSPA5 (0.80) HSPA5ALDH1A1HPGDCA12CA1
SCHEMBL30874252 0.83 HSPA5 (0.80) HSPA5ALDH1A1HPGDCA12CA1
SCHEMBL54577 0.83 HSPA5 (0.80) HSPA5ALDH1A1HPGDCA12CA1
SCHEMBL8837284 0.83 HSPA5 (0.55) HMGB1HSPA5ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230233516-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS TECHFIELDS PHARMA CO., LTD (CN) 2023-07-27 US disclosed
US-11541029-B2 High penetration compositions and their applications TECHFIELDS PHARMA CO., LTD. (CN) 2023-01-03 US disclosed
US-20110269689-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS PREMIER RESEARCH INTERNATIONAL, LLC 2011-11-03 US disclosed
EP-2370406-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS Yu, Chongxi (US) 2011-10-05 EP disclosed
WO-2010065936-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS YU CHONGXI (US) 2010-06-10 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 (3 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-20110269689-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS SLC19A1, HIRA, SLC43A1 HMGB1 190/4885HSPA5 4199/4885ALDH1A1 829/4885
US-11541029-B2 High penetration compositions and their applications SLC19A1, HIRA, SLC43A1 HMGB1 190/4885HSPA5 4199/4885ALDH1A1 829/4885
US-20230233516-A1 HIGH PENETRATION COMPOSITIONS AND THEIR APPLICATIONS SLC5A7, SLC19A1, SLC43A1 HMGB1 192/4885HSPA5 4747/4885ALDH1A1 2302/4885

“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.