SCHEMBL18480010

SCHEMBL18480010

CCCc1cc(C(C)=O)ccc1OCCOc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
CASP6 P55212 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.51
PPARG P37231 7/20 0.51
PPARA Q07869 6/20 0.51
PPARD Q03181 3/20 0.51
PKM P14618 1/20 0.48
GRM2 Q14416 1/20 0.47
RAB9A P51151 2/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 2/20 0.47
LTB4R Q15722 1/20 0.46

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
SCHEMBL18480014 0.91 POLB (0.59) POLBCASP6SMN1; SMN2PKMRAB9A
SCHEMBL15338464 0.83 MAOB (0.55) SMN1; SMN2RAB9AL3MBTL1MAPT
SCHEMBL20464837 0.82 LTB4R (0.53) POLBCASP6PPARGPPARAPPARD
SCHEMBL10927028 0.81 SMN1; SMN2 (0.53) POLBSMN1; SMN2L3MBTL1MAPTLTB4R
SCHEMBL18477955 0.81 POLB (0.57) POLBCASP6SMN1; SMN2PPARGPPARA
SCHEMBL18480023 0.80 POLB (0.56) POLBCASP6SMN1; SMN2PKMRAB9A
SCHEMBL18480016 0.80 POLB (0.63) POLBCASP6SMN1; SMN2PKMRAB9A
SCHEMBL18480022 0.80 POLB (0.56) POLBCASP6SMN1; SMN2PKMRAB9A
SCHEMBL6938382 0.79 PPARG (0.64) PPARGPPARAPPARDLMNAMAPK1
SCHEMBL6936861 0.77 PPARA (0.59) PPARGPPARAPPARDLMNAL3MBTL1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017022471-A1 THERMOCHROMIC COLOR-MEMORY COMPOSITION AND THERMOCHROMIC COLOR-MEMORY MICROCAPSULE PIGMENT ENCAPSULATING SAME パイロットインキ株式会社 2017-02-09 WO disclosed