SCHEMBL18875227

SCHEMBL18875227

COC(=O)c1ccc(Br)c(N2c3ccccc3Oc3ccccc32)c1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.53
▸ P2RX4 Q99571 5/20 0.48
▸ TRPA1 O75762 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ NOTUM Q6P988 1/20 0.42
▸ KIF11 P52732 1/20 0.41
▸ TSHR P16473 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ XDH P47989 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CA14 Q9ULX7 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL18875275 0.84 ALOX5 (0.53) ALOX5P2RX4TRPA1ALDH1A1LMNA
SCHEMBL18875290 0.83 TDP1 (0.54) ALOX5P2RX4ALDH1A1LMNA
SCHEMBL18875262 0.80 MEN1 (0.51) ALOX5P2RX4TRPA1ALDH1A1LMNA
SCHEMBL28536428 0.79 P2RX4 (0.54) ALOX5P2RX4TRPA1ALDH1A1LMNA
SCHEMBL18875260 0.79 NPC1 (0.49) ALOX5ALDH1A1LMNANPC1RAB9A
SCHEMBL13024155 0.78 ALOX5 (0.52) ALOX5P2RX4TRPA1ALDH1A1LMNA
SCHEMBL18875280 0.78 P2RX4 (0.47) ALOX5P2RX4TRPA1ALDH1A1NOTUM
SCHEMBL9886623 0.76 P2RX4 (0.57) ALOX5P2RX4TRPA1ALDH1A1LMNA
SCHEMBL18878343 0.74 HDAC1 (0.43) ALDH1A1LMNACA12CA1CA7
SCHEMBL18288011 0.74 ALOX5 (0.68) ALOX5P2RX4TRPA1ALDH1A1LMNA

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-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME WUHAN TIANMA MICROELECTRONICS CO., LTD.SHANGHAI BRANCH (CN) 2017-05-25 — — US disclosed
US-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME WUHAN TIANMA MICROELECTRONICS CO., LTD.SHANGHAI BRANCH (CN) 2017-05-25 — — 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-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME OR10J3, PPOX, OR51E2 ALOX5 1350/4885P2RX4 649/4885TRPA1 29/4885

“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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