SCHEMBL17853525

SCHEMBL17853525

c1ccc(-c2nc(-c3ccc(-c4ccncc4)cc3)cc(-c3ccc(-c4cccc5c4c4ccccc4n5-c4ccccc4)cc3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.43
▸ ALDH1A1 P00352 5/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ HPGD P15428 3/20 0.43
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ DHODH Q02127 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ KCNA5 P22460 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ NTSR1 P30989 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ SQOR Q9Y6N5 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ ATM Q13315 1/20 0.37

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
SCHEMBL24810943 0.93 MAPT (0.43) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714849 0.92 MAPT (0.42) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714759 0.92 MAPT (0.42) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL22249647 0.91 MAPT (0.40) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17853528 0.90 DHODH (0.43) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL24753864 0.90 MAPT (0.39) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714842 0.90 MEN1 (0.40) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714821 0.90 MAPT (0.40) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714747 0.90 MAPT (0.40) MAPTALDH1A1KDM4EHPGDMEN1
SCHEMBL17714962 0.89 KDM4E (0.39) MAPTALDH1A1KDM4EHPGDMEN1

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-20160181564-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 — — US disclosed
US-20160181564-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 — — 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-20160181564-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE LEF1, PIEZO1, SLC39A11 MAPT 2833/4885ALDH1A1 408/4885KDM4E 2180/4885

“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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