SCHEMBL17618128

SCHEMBL17618128

c1ccc(-c2cc(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)nc(-c3cccc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.36
▸ MEN1 O00255 5/20 0.36
▸ MAPT P10636 5/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ GLA P06280 1/20 0.34
▸ NTSR1 P30989 1/20 0.32
▸ DHODH Q02127 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ TNF P01375 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ PTGER4 P35408 1/20 0.30
▸ PDE4B Q07343 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
SCHEMBL17618126 0.97 KMT2A (0.35) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618098 0.97 KMT2A (0.35) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17369025 0.97 KMT2A (0.38) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618133 0.97 KMT2A (0.35) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618116 0.96 MEN1 (0.34) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618142 0.95 MEN1 (0.35) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618106 0.95 KMT2A (0.35) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618120 0.94 MEN1 (0.37) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618112 0.94 MEN1 (0.34) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL17618135 0.94 KMT2A (0.36) KMT2AMEN1MAPTALDH1A1HPGD

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-20160087215-A1 NOVEL PYRIMIDINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES HODOGAYA CHEMICAL CO., LTD. (JP) 2016-03-24 — — US disclosed
US-20160087215-A1 NOVEL PYRIMIDINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES HODOGAYA CHEMICAL CO., LTD. (JP) 2016-03-24 — — 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-20160087215-A1 NOVEL PYRIMIDINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES SLC29A1, SLC29A2, DHX29 KMT2A 2216/4885MEN1 2846/4885MAPT 3660/4885

“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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