SCHEMBL22247643

SCHEMBL22247643

O=C1c2oc3ccc4ccccc4c3c2C(=O)c2oc3ccc4ccccc4c3c21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.54
▸ TDP1 Q9NUW8 2/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ AHR P35869 3/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ PAX8 Q06710 2/20 0.49
▸ CYP1A1 P04798 1/20 0.49
▸ FYN P06241 1/20 0.49
▸ MAPK3 P27361 1/20 0.49
▸ MCL1 Q07820 1/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NTRK1 P04629 1/20 0.45
▸ PLK3 Q9H4B4 1/20 0.45

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
SCHEMBL7575236 0.90 NTRK1 (0.55) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL7912365 0.76 ABCG2 (0.60) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL30091394 0.75 TDP1 (0.55) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL415466 0.75 TDP1 (0.55) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL1619646 0.75 TDP1 (0.70) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL23621000 0.74 NTRK1 (0.61) ABCG2MEN1CYP3A4MAPTKMT2A
SCHEMBL11776616 0.73 TDP1 (0.68) ABCG2TDP1L3MBTL1AHRCYP1A2
SCHEMBL7569904 0.73 NTRK1 (0.44) L3MBTL1AHRCYP1A2MEN1CYP3A4
SCHEMBL7574891 0.73 NTRK1 (0.44) ABCG2TDP1PAX8MCL1MEN1
SCHEMBL3698658 0.72 MAOA (0.63) ABCG2TDP1L3MBTL1AHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200231602-A1 ORGANIC COMPOUND AND ELECTROLUMINESCENT DEVICE CONTAINING THE SAME Beijing Summer Sprout Technology Co., Ltd. (CN) 2020-07-23 — — 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-20200231602-A1 ORGANIC COMPOUND AND ELECTROLUMINESCENT DEVICE CONTAINING THE SAME OCIAD1, OCIAD2, SLCO4C1 ABCG2 1110/4885TDP1 2541/4885L3MBTL1 1991/4885

“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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