SCHEMBL2492787

SCHEMBL2492787

Cc1ccc(C=CN(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.53
HPGD P15428 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
CYP3A4 P08684 1/20 0.44
RELA Q04206 2/20 0.44
NFE2L2 Q16236 3/20 0.43
CYP1B1 Q16678 1/20 0.41
FGF23 Q9GZV9 1/20 0.40
CA1 P00915 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
ACHE P22303 1/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 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
SCHEMBL17255707 1.00 TRPM8 (0.53) TRPM8HPGDALDH1A1MAPTCYP3A4
SCHEMBL3282954 0.92 RELA (0.48) TRPM8HPGDALDH1A1MAPTCYP3A4
Benzene SCHEMBL6405642 0.85 MAOB (0.48) TRPM8ALDH1A1MAPTRELANFE2L2
SCHEMBL4444201 0.85 MAOB (0.48) TRPM8ALDH1A1MAPTRELANFE2L2
SCHEMBL988301 0.85 MAOB (0.48) TRPM8ALDH1A1MAPTRELANFE2L2
SCHEMBL8377021 0.84 NFE2L2 (0.49) TRPM8HPGDALDH1A1MAPTCYP3A4
SCHEMBL12576207 0.82 NFE2L2 (0.45) TRPM8ALDH1A1MAPTRELANFE2L2
SCHEMBL27986727 0.82 RELA (0.45) TRPM8HPGDALDH1A1MAPTCYP3A4
SCHEMBL1568910 0.81 RELA (0.41) TRPM8HPGDALDH1A1MAPTCYP3A4
SCHEMBL30561197 0.80 NFE2L2 (0.59) ALDH1A1MAPTRELANFE2L2TSHR

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
EP-1730101-B1 ALKYLATED PANA AND DPA COMPOSITIONS BASF SE (DE) 2015-11-18 EP disclosed
US-8030259-B2 Antioxidant; heat resistance; photostability mixture; stabilization of material CIBA SPECIALITY CHEMICALS CORP. (US) 2011-10-04 US disclosed
US-20080274925-A1 Alkylated Pana and Dpa Compositions CIBA SPECIALTY CHEMICALS CORP. 2008-11-06 US disclosed