SCHEMBL10028253

SCHEMBL10028253

COc1cc2ccccc2c2c1-c1nccnc1C2(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 1/20 0.38
▸ SOS1 Q07889 1/20 0.38
▸ CES2 O00748 2/20 0.38
▸ PDGFRB P09619 2/20 0.37
▸ PDGFRA P16234 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ITK Q08881 1/20 0.35
▸ NQO1 P15559 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CYP19A1 P11511 1/20 0.35
▸ CYP11B1 P15538 1/20 0.35
▸ CYP11B2 P19099 1/20 0.35

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
SCHEMBL10000611 0.83 MEN1 (0.38) MAPTALDH1A1LMNAKDM4EMEN1
SCHEMBL10000610 0.81 TRPM4 (0.38) MAPTALDH1A1LMNAKDM4EMEN1
SCHEMBL10027746 0.77 PDGFRB (0.39) KRASSOS1PDGFRBPDGFRAMAPT
SCHEMBL10028255 0.71 MAPT (0.47) KRASSOS1PDGFRBPDGFRAMAPT
SCHEMBL10028257 0.69 MAPT (0.42) KRASSOS1PDGFRBPDGFRAMAPT
SCHEMBL24349338 0.69 KMT2A (0.40) MAPTALDH1A1NPSR1LMNAKDM4E
SCHEMBL22291695 0.65 MAPT (0.57) MAPTALDH1A1NPSR1LMNAKDM4E
SCHEMBL10028042 0.64 MAPT (0.41) MAPTALDH1A1ITKMEN1KMT2A
SCHEMBL1408342 0.64 MAPT (0.37) MAPTALDH1A1NPSR1LMNAKDM4E
SCHEMBL7989542 0.64 MAPT (0.50) MAPTALDH1A1NPSR1KDM4ENQO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 — — US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 — — US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 — — 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 (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-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 KRAS 2932/4885SOS1 477/4885CES2 3224/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 KRAS 2932/4885SOS1 477/4885CES2 3224/4885

“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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