SCHEMBL13199302

SCHEMBL13199302

Cc1cc(C(=O)O)cc(O)c1C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 4/20 0.56
▸ CA1 P00915 4/20 0.56
▸ CA2 P00918 4/20 0.56
▸ CA7 P43166 4/20 0.56
▸ CA9 Q16790 4/20 0.56
▸ CA14 Q9ULX7 4/20 0.56
▸ CA4 P22748 3/20 0.56
▸ CA6 P23280 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ CA3 P07451 2/20 0.56
▸ CA5A P35218 2/20 0.56
▸ CA5B Q9Y2D0 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.56
▸ LMNA P02545 1/20 0.56
▸ TP53 P04637 1/20 0.56
▸ SELL P14151 1/20 0.56
▸ HPGD P15428 1/20 0.56
▸ SELP P16109 1/20 0.56
▸ FUT4 P22083 1/20 0.56

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
SCHEMBL1919748 0.88 CA12 (0.64) CA12CA1CA2CA7CA9
Water SCHEMBL4387068 0.86 CA12 (0.61) CA12CA1CA2CA7CA9
Water SCHEMBL4387073 0.86 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL1572119 0.85 TPMT (0.59) CA12CA1CA2CA7CA9
SCHEMBL6909846 0.83 TPMT (0.56) CA12CA1CA2CA7CA9
SCHEMBL6916910 0.83 TPMT (0.56) CA12CA1CA2CA7CA9
SCHEMBL6909433 0.83 TPMT (0.56) CA12CA1CA2CA7CA9
SCHEMBL6908978 0.83 TPMT (0.56) CA12CA1CA2CA7CA9
SCHEMBL6912583 0.83 TPMT (0.56) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL10831952 0.83 TPMT (0.56) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912736-B2 Diaryl trehalose compounds and uses thereof THE UNIVERSITY OF MONTANA (US) 2024-02-27 — — US disclosed
CN-113748021-A Method for producing liquid crystal polyester processed product 本州化学工业株式会社 2021-12-03 — — CN disclosed
US-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 — — US disclosed
US-8809451-B2 Fluorinated dicarboxylic acid derivative and polymer obtained therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2014-08-19 — — US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 — — US disclosed
US-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom CENTRAL GLASS COMPANY, LIMITED (JP) 2011-12-08 — — US disclosed
WO-2010095678-A1 FLUORINATED DICARBOXYLIC ACID DERIVATIVE AND POLYMER OBTAINED THEREFROM セントラル硝子株式会社 (JP) 2010-08-26 — — WO disclosed
WO-2010044404-A1 FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES キッセイ薬品工業株式会社 (JP) 2010-04-22 — — 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 (2 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-20110301305-A1 Fluorinated Dicarboxylic Acid Derivative and Polymer Obtained Therefrom MCCC2, AFF2, F13A1 CA12 11/4885CA1 5/4885CA2 7/4885
US-11912736-B2 Diaryl trehalose compounds and uses thereof TREH, STT3B, DDOST CA12 757/4885CA1 1399/4885CA2 1958/4885

“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.

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