SCHEMBL13400577

SCHEMBL13400577

C=C(C)C(=O)OCCc1ccc(O)c(-n2n3c4ccc(OC)cc4n23)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ SLC6A2 P23975 1/20 0.36
▸ SLC6A3 Q01959 1/20 0.36
▸ MET P08581 5/20 0.36
▸ IGF1R P08069 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ APP P05067 2/20 0.34
▸ YWHAG P61981 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ APEX1 P27695 1/20 0.34

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
SCHEMBL12215326 0.87 APP (0.40) MAPTSMN1; SMN2KDM4ELMNATP53
SCHEMBL13400575 0.87 APP (0.35) LMNAMETIGF1RALOX15ALOX5
SCHEMBL13839012 0.84 APP (0.41) SMN1; SMN2ALOX5APPYWHAGPOLB
SCHEMBL13400581 0.83 RIPK1 (0.33) METALOX5APPYWHAGPOLB
SCHEMBL13400579 0.82 SLC7A5 (0.32) APPYWHAGPOLBAPEX1HTT
SCHEMBL813463 0.81 APP (0.38) ALOX5APPPOLBAPEX1HTT
SCHEMBL13159307 0.81 APP (0.38) ALOX5APPPOLBAPEX1HTT
SCHEMBL13159274 0.80 POLB (0.37) NPC1MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL813113 0.80 POLB (0.37) NPC1MAPTRAB9ASMN1; SMN2KDM4E
SCHEMBL13400580 0.80 TSHR (0.37) CYP1A2CYP3A4

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-20100103352-A1 OPTICAL FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY AND ULTRAVIOLET ABSORBING POLYMER KONICA MINOLTA OPTO, INC. (JP) 2010-04-29 — — US disclosed
US-20100103352-A1 OPTICAL FILM, POLARIZING PLATE, LIQUID CRYSTAL DISPLAY AND ULTRAVIOLET ABSORBING POLYMER KONICA MINOLTA OPTO, INC. (JP) 2010-04-29 — — US disclosed
Send feedback