SCHEMBL14280093

SCHEMBL14280093

CC(C)(c1ccccc1)c1ccc(OCOc2ccc(C(C)(C)c3ccccc3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.66
▸ KMT2A Q03164 7/20 0.60
▸ MEN1 O00255 6/20 0.60
▸ KDM4E B2RXH2 8/20 0.55
▸ POLB P06746 2/20 0.55
▸ ALDH1A1 P00352 7/20 0.54
▸ HTT P42858 1/20 0.54
▸ ESR1 P03372 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ ESR2 Q92731 1/20 0.52
▸ NPC1 O15118 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ LMNA P02545 2/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ TP53 P04637 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ PPARG P37231 1/20 0.49

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
SCHEMBL12128744 0.86 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL9787289 0.86 SMN1; SMN2 (0.74) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL13382511 0.85 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL2787580 0.84 SMN1; SMN2 (0.62) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL28908712 0.84 SMN1; SMN2 (0.62) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL8672714 0.83 SMN1; SMN2 (0.71) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL13979428 0.83 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL8673557 0.82 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AMEN1KDM4EPOLB
SCHEMBL1681364 0.82 SMN1; SMN2 (0.60) SMN1; SMN2KMT2AMEN1ALDH1A1ESR1
SCHEMBL13641412 0.82 SMN1; SMN2 (0.70) SMN1; SMN2KMT2AMEN1KDM4EPOLB

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-7314897-B2 Aromatic formals as additives for lowering the water uptake of polycarbonates BAYER MATERIALSCIENCE AG (DE) 2008-01-01 — — US disclosed
US-7314897-B2 Aromatic formals as additives for lowering the water uptake of polycarbonates BAYER MATERIALSCIENCE AG (DE) 2008-01-01 — — US disclosed
EP-1664174-B1 AROMATIC FORMALS USED AS ADDITIVES FOR REDUCING THE WATER ABSORPTION OF POLYCARBONATES BAYER MATERIALSCIENCE AG (DE) 2007-05-30 — — EP disclosed
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