SCHEMBL16201698

SCHEMBL16201698

CCC(C)(C)c1cc(C)c(OC(C)(C)C)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.37
RAB9A P51151 4/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
LMNA P02545 1/20 0.37
CASP3 P42574 1/20 0.37
ATM Q13315 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
MAPT P10636 4/20 0.35
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
NPSR1 Q6W5P4 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
HTT P42858 2/20 0.33
UBE2N P61088 2/20 0.33
GLA P06280 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL16201611 0.86 MAPK1 (0.36) MAPK1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL16207348 0.86 MAPK1 (0.36) MAPK1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL16207350 0.82 CYP3A4 (0.31)
SCHEMBL14325350 0.81 ALDH1A1 (0.42) MAPK1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL13753107 0.78 POLB (0.46) MAPK1LMNAATMMAPTALDH1A1
SCHEMBL12636687 0.76 NPC1 (0.35) MAPK1RAB9ASMN1; SMN2NPC1LMNA
SCHEMBL27122563 0.75 CYP1A2 (0.38) ALDH1A1CYP2C9
SCHEMBL19047018 0.75 MAPT (0.37) SMN1; SMN2LMNAMAPTNPSR1KMT2A
SCHEMBL24145445 0.74
SCHEMBL780091 0.74 NPC1 (0.43) MAPK1RAB9ASMN1; SMN2NPC1LMNA

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-9012572-B2 Polyphenylene ether oligomer and article employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-04-21 US disclosed
US-20140323666-A1 POLYPHENYLENE ETHER OLIGOMER AND ARTICLE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed
US-20140322545-A1 RESIN COMPOSITION, PREPREG, AND SUBSTRATE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed