SCHEMBL4910213

SCHEMBL4910213

COC(=O)c1ccc2c(c1)C(C)(O)c1ccccc1-2

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 14/20 0.68
PTPRC P08575 1/20 0.46
TSHR P16473 1/20 0.44
EGFR P00533 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
XDH P47989 1/20 0.44
CA9 Q16790 1/20 0.44
CA14 Q9ULX7 1/20 0.44
HTR7 P34969 1/20 0.43
HTR2B P41595 1/20 0.43
PTGS2 P35354 1/20 0.43

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
SCHEMBL26120223 0.91 PDK2 (0.72) PDK2PTPRCTSHRCA12CA1
SCHEMBL4914219 0.84 PDK2 (0.63) PDK2PTPRCTSHREGFRCA12
SCHEMBL30571998 0.83 PDK2 (0.55) PDK2PTPRCHTR7HTR2B
SCHEMBL4915761 0.83 PDK2 (0.55) PDK2PTPRCHTR7HTR2B
SCHEMBL13128005 0.81 PDK2 (1.00) PDK2
SCHEMBL4910149 0.80 PDK2 (0.59) PDK2TSHREGFRCA12CA1
SCHEMBL30571665 0.80 PDK2 (0.70) PDK2PTPRCTSHRCA12CA1
SCHEMBL26120111 0.80 PDK2 (0.70) PDK2PTPRCTSHRCA12CA1
SCHEMBL21135534 0.79 PDK2 (0.61) PDK2TSHREGFRCA12CA1
SCHEMBL4918215 0.79 PDK2 (0.61) PDK2PTPRCTSHREGFRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346585-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2025-11-13 US disclosed
WO-2023183405-A2 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2023-09-28 WO disclosed
WO-2023183405-A2 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2023-09-28 WO disclosed
US-20080200551-A1 Flourene Derivative ASTELLAS PHARMA INC. (JP) 2008-08-21 US disclosed
US-20080171788-A1 Medicament For Irritable Bowel Syndrome ASTELLAS PHARMA INC. (JP) 2008-07-17 US disclosed
US-20080161419-A1 Prophylactic Antimigraine Agents ASTELLAS PHARMA INC. (JP) 2008-07-03 US disclosed
EP-1852129-A1 REMEDY FOR IRRITABLE BOWEL SYNDROME Astellas Pharma Inc. (JP) 2007-11-07 EP disclosed
EP-1728784-A1 FLUORENE DERIVATIVE Astellas Pharma Inc. (JP) 2006-12-06 EP disclosed
EP-1716867-A1 PREVENTIVES FOR MIGRAINE Astellas Pharma Inc. (JP) 2006-11-02 EP disclosed
CN-1842517-A Fluorene derivatives ASTELLAS PHARMA INC (JP) 2006-10-04 CN 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 (4 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-20250346585-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS C5, C1S, C9 PDK2 3616/4885PTPRC 2222/4885TSHR 3056/4885
US-20080161419-A1 Prophylactic Antimigraine Agents HTR2B, HTR7, HTR1A PDK2 4410/4885PTPRC 2235/4885TSHR 730/4885
US-20080200551-A1 Flourene Derivative HTR2B, HTR7, HTR2C PDK2 4775/4885PTPRC 2610/4885TSHR 306/4885
US-20080171788-A1 Medicament For Irritable Bowel Syndrome HTR7, HTR5A, HTR3B PDK2 4110/4885PTPRC 1236/4885TSHR 1154/4885

“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.