SCHEMBL11253344

SCHEMBL11253344

COc1ccc(CC2=Nc3cnc4ccccc4c3N(C(C)=O)N2)cc1OC

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ ACHE P22303 6/20 0.41
▸ APP P05067 4/20 0.41
▸ LMNA P02545 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
Hydrochloric Acid SCHEMBL11361444 0.99 MAPT (0.41) MAPTNPSR1ACHEAPPLMNA
SCHEMBL11249911 0.85 BCHE (0.37) KMT2A
Hydrochloric Acid SCHEMBL11357746 0.84 BCHE (0.37) KMT2A
SCHEMBL11246079 0.81 MAPT (0.43) MAPTNPSR1ACHEAPPLMNA
SCHEMBL11251660 0.78 BCHE (0.38) ACHEPOLBMEN1KMT2A
Hydrochloric Acid SCHEMBL11389008 0.77 BCHE (0.38) ACHEPOLBMEN1KMT2A
SCHEMBL11040120 0.77 DUSP10 (0.33) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL11038147 0.77 USP5 (0.35) LMNATSHRALDH1A1SMN1; SMN2MEN1
SCHEMBL11038211 0.76 PDE4A (0.41) MAPTLMNAALDH1A1
Hydrochloric Acid SCHEMBL11041821 0.76 DUSP10 (0.33) LMNAALDH1A1SMN1; SMN2MEN1KMT2A

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-4342766-A SAID COMPOUNDS POSSESS ANTIPHLOGISTIC, ANALGESIC, ANTICONVULSIVE AND TRANQUILIZING PROPERTIES EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-08-03 — — US disclosed
EP-0038528-A1 Dihydro-as-triazino(5,6-c)quinoline derivatives, process for their preparation and pharmaceutical compositions containing these compounds EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1981-10-28 — — EP disclosed
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