SCHEMBL2087642

SCHEMBL2087642

Oc1cc(O)cc(Nc2nc(Nc3cc(O)cc(O)c3)nc(Nc3cc(O)cc(O)c3)n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.42
▸ LMNA P02545 1/20 0.39
▸ SYK P43405 7/20 0.39
▸ RHOA P61586 1/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ DDX3X O00571 1/20 0.36
▸ RECQL P46063 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ ZAP70 P43403 1/20 0.35
▸ NQO2 P16083 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ KCNH3 Q9ULD8 1/20 0.33

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
SCHEMBL12785977 0.81 DDX3X (0.43) LMNASYKKMT2AMEN1MAPT
SCHEMBL31579242 0.80 BACE1 (0.57) BACE1LMNAKMT2AMEN1MAPT
SCHEMBL23868902 0.80 ALDH5A1 (0.44) RHOAKMT2AMEN1MAPTKDM4E
SCHEMBL7564159 0.77 SYK (0.64) SYKRHOAKMT2AMEN1HDAC6
SCHEMBL22356493 0.75 SYK (0.62) SYKRHOAKMT2AMEN1HDAC6
SCHEMBL5959433 0.74 AURKA (0.59) LMNASYKKMT2AMEN1MAPT
SCHEMBL7961759 0.73 TTR (0.44) KMT2AMEN1MAPTMAPK1GAA
SCHEMBL7960772 0.73 CYP3A4 (0.44) SYKRHOAKMT2AMEN1MAPT
SCHEMBL29819598 0.72 CYP3A4 (0.74) SYKRHOAKMT2AMEN1MAPT
SCHEMBL12513290 0.72 CYP3A4 (0.74) SYKRHOAKMT2AMEN1MAPT

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-20210301180-A1 COMPOSITION, THERMALLY CONDUCTIVE SHEET, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2021-09-30 — — US disclosed
US-20110064892-A1 Polycyclic Organic Compounds, Retardation Layer and Compensation Panel on Their Base CRYSOPTIX KK 2011-03-17 — — US disclosed
EP-2260036-A2 POLYCYCLIC ORGANIC COMPOUNDS, RETARDATION LAYER AND COMPENSATION PANEL ON THEIR BASE CRYSOPTIX K.K. (JP) 2010-12-15 — — EP disclosed
WO-2009109782-A2 POLYCYCLIC ORGANIC COMPOUNDS, RETARDATION LAYER AND COMPENSATION PANEL ON THEIR BASE CRYSOPTIX K.K. (JP) 2009-09-11 — — 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 (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-20110064892-A1 Polycyclic Organic Compounds, Retardation Layer and Compensation Panel on Their Base MCM3, CCNA2, CCNB2 BACE1 2184/4885LMNA 115/4885SYK 3171/4885

“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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