SCHEMBL16964304

SCHEMBL16964304

Nc1cc(C(=O)Nc2ccncc2)ccn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.61
▸ GAA P10253 2/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ HTT P42858 2/20 0.56
▸ JAK2 O60674 1/20 0.56
▸ TYK2 P29597 1/20 0.56
▸ NT5E P21589 2/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ GABRP O00591 1/20 0.54
▸ GABRD O14764 1/20 0.54
▸ GABRA1 P14867 1/20 0.54
▸ GABRB1 P18505 1/20 0.54
▸ GABRG2 P18507 1/20 0.54
▸ GABRB3 P28472 1/20 0.54
▸ GABRA5 P31644 1/20 0.54

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
SCHEMBL14062132 0.87 LMNA (0.62) KDM4EHTTJAK2TYK2NPC1
SCHEMBL24010215 0.86 KCNK3 (0.58) KDM4EHTTJAK2TYK2NT5E
SCHEMBL27613759 0.84 MAPK1 (0.62) KDM4EGAAKMT2AMEN1JAK2
SCHEMBL1898755 0.80 GAA (0.91) KDM4EGAAL3MBTL1KMT2AMEN1
SCHEMBL16702237 0.80 HTT (0.55) GAAL3MBTL1KMT2AMEN1HTT
SCHEMBL10483323 0.79 GABRP (0.53) KDM4EGAAL3MBTL1KMT2AMEN1
SCHEMBL17803600 0.79 RAB9A (0.57) NPC1RAB9AGABRPGABRDGABRA1
SCHEMBL2955207 0.79 KDM4E (0.68) KDM4EGAAL3MBTL1KMT2AMEN1
SCHEMBL19774543 0.79 KDM4E (0.80) KDM4EGAAL3MBTL1KMT2AMEN1
SCHEMBL14308003 0.78 MEN1 (0.66) KDM4EKMT2AMEN1HTTJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11427566-B2 Compounds useful for treating cancer ABIVAX (FR) 2022-08-30 — — US disclosed
US-20200239444-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2020-07-30 — — US disclosed
US-10717724-B2 Compounds useful for treating cancer ABIVAX (FR) 2020-07-21 — — US disclosed
US-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2018-08-09 — — US disclosed
US-9969715-B2 Compounds useful for treating cancer ABIVAX (FR) 2018-05-15 — — US disclosed
EP-2900635-B1 NEW ANTI-INVASIVE COMPOUNDS ABIVAX (FR) 2016-07-13 — — EP disclosed
US-20150315173-A1 NEW ANTI-INVASIVE COMPOUNDS UNIVERSITE DE MONTPELLIER (FR) 2015-11-05 — — US disclosed
EP-2900635-A1 NEW ANTI-INVASIVE COMPOUNDS ABIVAX (FR) 2015-08-05 — — EP 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 (5 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-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER PRMT7, PRMT6, RRM2 KDM4E 1436/4885GAA 4810/4885L3MBTL1 1527/4885
US-20150315173-A1 NEW ANTI-INVASIVE COMPOUNDS MIF, MMP7, MMP8 KDM4E 2252/4885GAA 4616/4885L3MBTL1 2247/4885
US-10717724-B2 Compounds useful for treating cancer PRMT7, PRMT6, RRM2 KDM4E 1436/4885GAA 4810/4885L3MBTL1 1527/4885
US-20200239444-A1 COMPOUNDS USEFUL FOR TREATING CANCER PRMT7, PRMT6, RRM2 KDM4E 1246/4885GAA 4834/4885L3MBTL1 1595/4885
US-11427566-B2 Compounds useful for treating cancer PRMT7, PRMT6, RRM2 KDM4E 1246/4885GAA 4834/4885L3MBTL1 1595/4885

“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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