SCHEMBL9170911

SCHEMBL9170911

c1ccc(-c2ccnc(Oc3ncncn3)n2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.48
▸ LMNA P02545 3/20 0.48
▸ CCR1 P32246 3/20 0.48
▸ CCR5 P51681 3/20 0.48
▸ CCR8 P51685 3/20 0.48
▸ HTT P42858 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ ALOX15 P16050 3/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ ALPL P05186 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ ALPI P09923 1/20 0.48
▸ ALPG P10696 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ METAP1 P53582 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ BLM P54132 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
SCHEMBL1181563 0.72 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29148818 0.70 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
SCHEMBL29394083 0.70 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
SCHEMBL4294864 0.70 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3036765 0.70 KDM4E (0.82) KDM4ELMNACCR1CCR5CCR8
SCHEMBL667593 0.70 AURKA (0.57) KDM4ELMNAHTTSMN1; SMN2L3MBTL1
SCHEMBL6535045 0.69 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
SCHEMBL776048 0.69 KDM4E (0.67) KDM4ELMNACCR1CCR5CCR8
SCHEMBL7964803 0.68 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Terpyridine SCHEMBL29357603 0.68 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596899-B1 NEW MIXTURES OF HERBICIDES AND ANTIDOTES HOECHST SCHERING AGREVO GMBH (DE) 1995-04-26 — — EP disclosed
EP-0596899-A1 NEW MIXTURES OF HERBICIDES AND ANTIDOTES. HOECHST AG (DE) 1994-05-18 — — EP disclosed
WO-1993000010-A1 NEW MIXTURES OF HERBICIDES AND ANTIDOTES HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-07 — — WO disclosed
EP-0521407-A1 New mixtures of herbicides and antidotes Hoechst Schering AgrEvo GmbH (DE) 1993-01-07 — — EP disclosed
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