SCHEMBL13864962

SCHEMBL13864962

COC(=O)c1cccc(C(=O)Oc2c(C)cc(C(C)(C)c3cc(C)c(C)c(C)c3)cc2C)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.42
▸ CYP4F2 P78329 2/20 0.41
▸ CYP4A11 Q02928 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RAB9A P51151 3/20 0.40
▸ POLB P06746 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ NPC1 O15118 2/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PRSS1 P07477 1/20 0.39
▸ ACR P10323 1/20 0.39
▸ IL2 P60568 1/20 0.39
▸ TCF4 P15884 1/20 0.39
▸ CTNNB1 P35222 1/20 0.39
▸ HIF1A Q16665 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
SCHEMBL13864911 0.90 TDP1 (0.47) LOXL2TSHRRAB9AALDH1A1NPC1
SCHEMBL17756688 0.87 LOXL2 (0.45) LOXL2CYP4F2CYP4A11TSHRRAB9A
SCHEMBL13864965 0.87 TSHR (0.44) LOXL2CYP4F2CYP4A11TSHRRAB9A
SCHEMBL13865022 0.86 TDP1 (0.44) RAB9AALDH1A1NPC1MAPT
SCHEMBL13864987 0.85 TSHR (0.45) LOXL2CYP4F2CYP4A11TSHRRAB9A
SCHEMBL13865019 0.85 NOTUM (0.40) LOXL2CYP4F2CYP4A11TSHRRAB9A
SCHEMBL13030397 0.84 CA1 (0.44) TSHRALDH1A1MAPTPRSS1ACR
SCHEMBL12346020 0.84 ESR1 (0.41) TSHRRAB9APOLBALDH1A1ESR1
SCHEMBL13864971 0.83 LOXL2 (0.49) LOXL2CYP4F2CYP4A11TSHRRAB9A
SCHEMBL13864990 0.82 PPARA (0.44) LOXL2CYP4F2CYP4A11TSHRRAB9A

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
US-20090123854-A1 IMAGE FORMING METHOD KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2009-05-14 — — US disclosed
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