SCHEMBL27338014

SCHEMBL27338014

CC(C)(C)c1ccc(OC(Oc2ccc(C(C)(C)C)cc2C(C)(C)C)Oc2ccc(C(C)(C)C)cc2C(C)(C)C)c(C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
APEX1 P27695 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ATM Q13315 1/20 0.36
NPC1 O15118 1/20 0.36
PLA2G1B P04054 1/20 0.36
NFKB1 P19838 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SENP8 Q96LD8 1/20 0.36

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
SCHEMBL19651157 0.88 L3MBTL1 (0.35) CA1CA2CA9APEX1L3MBTL1
SCHEMBL13019327 0.86 CA1 (0.40) CA1CA2CA9APEX1L3MBTL1
SCHEMBL15122416 0.83 APEX1 (0.39) CA1CA2CA9APEX1L3MBTL1
SCHEMBL18948601 0.83 L3MBTL1 (0.38) CA1CA2CA9APEX1L3MBTL1
SCHEMBL28425202 0.81 CA1 (0.44) CA1CA2CA9APEX1L3MBTL1
SCHEMBL22874094 0.80 HPGD (0.40) CA1CA2CA9APEX1L3MBTL1
SCHEMBL26607 0.80 CA1 (0.41) CA1CA2CA9APEX1L3MBTL1
SCHEMBL29349873 0.80 CA1 (0.41) CA1CA2CA9APEX1L3MBTL1
SCHEMBL9347011 0.80 CA1 (0.41) CA1CA2CA9APEX1L3MBTL1
SCHEMBL11954800 0.79 CA1 (0.43) CA1CA2CA9APEX1L3MBTL1

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
WO-2024123510-A1 PROCESS OF CONTROLLING HEAVIES IN A RECYCLE CATALYST STREAM DOW TECHNOLOGY INVESTMENTS LLC (US) 2024-06-13 WO disclosed