SCHEMBL935544

SCHEMBL935544

CCCCCCCCCCCCCCCC(=O)C1=C(O)C(COC(=O)c2ccc(C(=O)c3ccccc3)cc2)OC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 14/20 1.00
▸ PTPN1 P18031 7/20 1.00
▸ ACP1 P24666 5/20 1.00
▸ DUSP3 P51452 11/20 0.57
▸ HPSE Q9Y251 2/20 0.57
▸ MAPT P10636 1/20 0.57
▸ RECQL P46063 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ PTPN2 P17706 1/20 0.57
▸ CDC25A P30304 9/20 0.45
▸ CDC25C P30307 2/20 0.40
▸ P2RX3 P56373 1/20 0.40
▸ KLK7 P49862 1/20 0.39
▸ KLK5 Q9Y337 1/20 0.39

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
SCHEMBL7963589 0.80 CDC25B (1.00) CDC25BPTPN1ACP1DUSP3HPSE
SCHEMBL935543 0.78 PTPN1 (0.63) CDC25BPTPN1ACP1HPSEMAPT
SCHEMBL4403663 0.73 CDC25B (1.00) CDC25BPTPN1ACP1DUSP3HPSE
SCHEMBL1030268 0.73 CDC25B (1.00) CDC25BPTPN1ACP1DUSP3HPSE
SCHEMBL28550801 0.72 CDC25B (0.97) CDC25BPTPN1ACP1DUSP3HPSE
SCHEMBL19757457 0.72 L3MBTL1 (0.69) MAPTTDP1
SCHEMBL19757418 0.72 L3MBTL1 (0.69) MAPTTDP1
SCHEMBL19757415 0.72 L3MBTL1 (0.69) MAPTTDP1
SCHEMBL19757451 0.72 L3MBTL1 (0.69) MAPTTDP1
SCHEMBL19757417 0.72 L3MBTL1 (0.69) MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9668959-B2 A3 adenosine receptor ligands for modulation of pigmentation ORADIN PHARMACEUTICAL LTD. (IL) 2017-06-06 — — US disclosed
EP-2456419-B1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD (IL) 2016-11-23 — — EP disclosed
US-20160136079-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD. (IL) 2016-05-19 — — US disclosed
US-9199102-B2 A3 adenosine receptor ligands for modulation of pigmentation ORADIN PHARMACEUTICAL LTD. (IL) 2015-12-01 — — US disclosed
US-20120134945-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION ORADIN PHARMACEUTICAL LTD. (IL) 2012-05-31 — — US disclosed
EP-2456419-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION Oradin Pharmaceutical Ltd. (IL) 2012-05-30 — — EP disclosed
WO-2011010306-A1 A3 ADENOSINE RECEPTOR LIGANDS FOR MODULATION OF PIGMENTATION RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2011-01-27 — — WO disclosed
US-7019029-B2 Skin whiteners containing hydroxytetronic acid derivatives THE NORTHWESTERN MUTUAL LIFE INSURANCE COMPANY, AS ADMINISTRATIVE AGENT 2006-03-28 — — US disclosed
US-20020141956-A1 Skin whiteners containing hydroxytetronic acid derivatives THE NORTHWESTERN MUTUAL LIFE INSURANCE COMPANY, AS ADMINISTRATIVE AGENT 2002-10-03 — — 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-20020141956-A1 Skin whiteners containing hydroxytetronic acid derivatives TYR, PPP6C, CYP26A1 CDC25B 2448/4885PTPN1 77/4885ACP1 49/4885

“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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