SCHEMBL22227797

SCHEMBL22227797

OB(O)c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
PDK2 Q15119 17/20 0.46

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
SCHEMBL6293012 0.93 PDK2 (0.43) MGLLCA1CA2PDK2
SCHEMBL31367626 0.92 PDK2 (0.50) MGLLCA1CA2PDK2
SCHEMBL19383274 0.92 PDK2 (0.50) MGLLCA1CA2PDK2
SCHEMBL17470490 0.92 PDK2 (0.50) MGLLCA1CA2PDK2
SCHEMBL13599939 0.91 MGLL (0.49) MGLLCA1CA2PDK2
SCHEMBL26831143 0.90 MGLL (0.50) MGLLCA1CA2PDK2
SCHEMBL12551794 0.87 MGLL (0.56) MGLLCA1CA2PDK2
SCHEMBL30346522 0.86 CA1 (0.44) MGLLCA1CA2PDK2
SCHEMBL19193785 0.86 CA1 (0.44) MGLLCA1CA2PDK2
SCHEMBL29602907 0.86 CA1 (0.44) MGLLCA1CA2PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11807630-B2 Compound for organic electronic element, organic electronic element comprising the same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-11-07 US disclosed
US-20200277272-A1 COMPOUND HAVING PYRIMIDINE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENCE DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2020-09-03 US disclosed
EP-3683212-A1 COMPOUND HAVING PYRIMIDINE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2020-07-22 EP disclosed
CN-111094264-A Compound having pyrimidine ring structure and organic electroluminescent element 保土谷化学工业株式会社 2020-05-01 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 (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-20200277272-A1 COMPOUND HAVING PYRIMIDINE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENCE DEVICE SLC29A1, ADORA1, SLC29A2 MGLL 4314/4885CA1 4514/4885CA2 4203/4885
US-11807630-B2 Compound for organic electronic element, organic electronic element comprising the same, and electronic device thereof PIEZO1, OCIAD1, OR10J3 MGLL 3712/4885CA1 570/4885CA2 860/4885

“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.