SCHEMBL17279564

SCHEMBL17279564

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)cc5)ccc43)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 2/20 0.35
▸ PTGES O14684 1/20 0.34
▸ C5AR1 P21730 1/20 0.34
▸ NPY5R Q15761 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL15459662 0.84 TSPO (0.40) TSPOPTGESNPY5RMEN1KMT2A
SCHEMBL17228152 0.84 TSPO (0.40) TSPOPTGESNPY5RMEN1KMT2A
SCHEMBL25899011 0.84 TSPO (0.40) TSPOPTGESNPY5RMEN1KMT2A
SCHEMBL17720476 0.84 TSPO (0.38) TSPOPTGESNPY5R
SCHEMBL17720480 0.84 TSPO (0.38) TSPOPTGESNPY5R
SCHEMBL16977839 0.84 TSPO (0.40) TSPOPTGESNPY5RKMT2A
SCHEMBL17720373 0.83 KDM4E (0.42) TSPOPTGESNPY5RMEN1KMT2A
SCHEMBL11998239 0.83 PTGES (0.35) TSPOPTGESNPY5RESR1ESR2
SCHEMBL17720362 0.83 KDM4E (0.42) TSPOPTGESNPY5RMEN1KMT2A
SCHEMBL16985625 0.83 L3MBTL1 (0.42) TSPOPTGESNPY5RMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340626-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2015-11-26 — — US disclosed
US-20150340626-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2015-11-26 — — 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-20150340626-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 TSPO 1548/4885PTGES 1293/4885C5AR1 208/4885

“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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