SCHEMBL17301262

SCHEMBL17301262

CCc1ccc(C(=O)Oc2ccc(OC(=O)c3ccc(CC)cc3)c(OC)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.62
MAPT P10636 5/20 0.56
MEN1 O00255 3/20 0.52
CYP3A4 P08684 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
LMNA P02545 2/20 0.51
HTT P42858 2/20 0.51
NPC1 O15118 1/20 0.51
PRSS1 P07477 1/20 0.48
ACR P10323 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
GAA P10253 3/20 0.48
ALDH1A1 P00352 4/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
THRB P10828 1/20 0.47

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
SCHEMBL17301252 0.90 KMT2A (0.58) KMT2AMAPTMEN1CYP3A4TDP1
SCHEMBL17304613 0.89 KMT2A (0.77) KMT2AMAPTCYP3A4LMNAHTT
SCHEMBL31321665 0.89 MAPT (0.61) KMT2AMAPTMEN1CYP3A4TDP1
SCHEMBL17304614 0.88 KMT2A (0.59) KMT2AMAPTLMNANPC1ALDH1A1
SCHEMBL31321697 0.88 KMT2A (0.71) KMT2AMAPTMEN1CYP3A4TDP1
SCHEMBL17301256 0.88 KMT2A (0.56) KMT2AMAPTMEN1CYP3A4TDP1
SCHEMBL10039541 0.86 KMT2A (0.64) KMT2AMAPTMEN1NPC1SMN1; SMN2
SCHEMBL17301260 0.86 KMT2A (0.64) KMT2AMAPTMEN1LMNANPC1
SCHEMBL19623998 0.86 KMT2A (0.64) KMT2AMAPTLMNAHTTNPC1
SCHEMBL31321618 0.85 MAPT (0.56) KMT2AMAPTMEN1CYP3A4TDP1

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-20150344782-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION, POLYMER MATERIAL AND METHOD FOR MANUFACTURING THE SAME, AND FILM FUJIFILM CORPORATION (JP) 2015-12-03 US disclosed
US-9005906-B2 Tetrahydropyran nucleic acid analogs ISIS PHARMACEUTICALS, INC. (US) 2015-04-14 US disclosed