SCHEMBL8189724

SCHEMBL8189724

COc1ccc(C2=C3C=CC(=N3)C=C3C=CC(=N3)C=C3C=CC(=N3)C(c3ccc(OC)c(O)c3)=C3C=CC2=N3)cc1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TUBB1 Q9H4B7 6/20 0.33
▸ TUBB4A P04350 5/20 0.33
▸ TUBB P07437 5/20 0.33
▸ TUBA3C P0DPH7 5/20 0.33
▸ TUBA1B P68363 5/20 0.33
▸ TUBA4A P68366 5/20 0.33

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
SCHEMBL7259993 0.79 KDM4E (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL4266561 0.77 ME2 (0.34) KDM4EMEN1NPC1TP53MAPT
SCHEMBL27646301 0.76 KDM4E (0.30) KDM4EALDH1A1
SCHEMBL585529 0.76 CLK4 (0.39) KDM4ENPC1ALDH1A1TP53MAPT
SCHEMBL6804334 0.75 CYP1A1 (0.33) KDM4EALDH1A1CYP1A1CYP1B1CDK1
SCHEMBL7261530 0.74 ALDH1A1 (0.35) KDM4EMEN1NPC1ALDH1A1TP53
SCHEMBL584790 0.74 HSD17B1 (0.37) CDK1CCNB1PIK3CDSRCPIK3CA
SCHEMBL499169 0.74 PDE4A (0.44) KDM4EMEN1NPC1ALDH1A1HPGD
SCHEMBL28278669 0.73 — —
SCHEMBL28299925 0.73 QPCT (0.35) ALDH1A1HPGDHSD17B10PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6087493-A ENZYME IHIBITORS REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-07-11 — — US disclosed
EP-0988037-A1 PORPHYRIN COMPOUNDS AS TELOMERASE INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-03-29 — — EP disclosed
WO-1998033503-A1 PORPHYRIN COMPOUNDS AS TELOMERASE INHIBITORS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1998-08-06 — — WO disclosed
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