SCHEMBL8716309

SCHEMBL8716309

CC(C)(C)c1ccc2c3nc4nc(nc5[nH]c(nc6nc(nc([nH]3)c2c1)-c1ccccc1-6)c1ccccc51)-c1ccccc1-4

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 4/20 0.46
▸ MEN1 O00255 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PLA2G1B P04054 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ L3MBTL1 Q9Y468 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
SCHEMBL1392382 0.90 MEN1 (0.51) KIF11MEN1THRBAPEX1RECQL
SCHEMBL16427988 0.88 MEN1 (0.50) KIF11MEN1THRBAPEX1RECQL
SCHEMBL1392531 0.88 MEN1 (0.50) KIF11MEN1THRBAPEX1RECQL
SCHEMBL1027961 0.88 MEN1 (0.50) KIF11MEN1THRBAPEX1RECQL
SCHEMBL20164057 0.88 MEN1 (0.50) KIF11MEN1THRBAPEX1RECQL
SCHEMBL17092527 0.88 MEN1 (0.50) KIF11MEN1THRBAPEX1RECQL
Hydrochloric Acid SCHEMBL5886541 0.87 MEN1 (0.49) KIF11MEN1THRBAPEX1RECQL
Water SCHEMBL1393705 0.87 MEN1 (0.49) KIF11MEN1THRBAPEX1RECQL
SCHEMBL769737 0.86 MEN1 (0.41) KIF11MEN1THRBAPEX1RECQL
SCHEMBL769512 0.86 MEN1 (0.38) KIF11MEN1THRBAPEX1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820489-A1 HYBRID PHTHALOCYANINE DERIVATIVES AND THEIR USES BIOSITE DIAGNOSTICS INC. (US) 1998-01-28 — — EP disclosed
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