SCHEMBL21969405

SCHEMBL21969405

O=Cc1ccc2ccc3c(OC(=O)c4cc(OC(=O)c5cc(OCCCOc6ccc(O)cc6)cc(OCCCOc6ccc(O)cc6)c5)cc(OC(=O)c5cc(OCCCOc6ccc(O)cc6)cc(OCCCOc6ccc(O)cc6)c5)c4)ccc4ccc1c2c43

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ LMNA P02545 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ PRSS1 P07477 1/20 0.32
▸ ACR P10323 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SENP8 Q96LD8 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31

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
SCHEMBL22019173 0.89 — —
SCHEMBL21969404 0.85 MEN1 (0.34) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL21971923 0.84 LTA4H (0.37) MEN1KMT2AABCG2LMNAALDH1A1
SCHEMBL21969303 0.80 SENP1 (0.38) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL22019172 0.76 — —
SCHEMBL23153188 0.72 PRSS1 (0.33) KMT2ALMNAMAPTSMN1; SMN2PRSS1
SCHEMBL23720951 0.72 TRIM24 (0.36) ALDH1A1ESR1
SCHEMBL21969302 0.71 SERPINE1 (0.45) MEN1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL19504611 0.71 KMT2A (0.50) KMT2AABCG2LMNAALDH1A1MAPT
SCHEMBL24240941 0.69 LTA4H (0.33) MEN1KMT2AALDH1A1MAPTCYP1A2

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-11370950-B2 Surface-modified inorganic nitride, composition, thermally conductive material, and device with thermally conductive layer FUJIFILM CORPORATION (JP) 2022-06-28 — — US disclosed
US-20200140738-A1 SURFACE-MODIFIED INORGANIC NITRIDE, COMPOSITION, THERMALLY CONDUCTIVE MATERIAL, AND DEVICE WITH THERMALLY CONDUCTIVE LAYER FUJIFILM CORPORATION (JP) 2020-05-07 — — US disclosed
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