SCHEMBL15946552

SCHEMBL15946552

CCC(C)(C)C(=O)OCCOCCOc1ccc2cc(C(=O)O)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.47
KDM4E B2RXH2 4/20 0.46
HTT P42858 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PLA2G4B P0C869 1/20 0.42
KMT2A Q03164 1/20 0.42
THRA P10827 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL12112343 0.86 KDM4E (0.59) KDM4EHTTKMT2AMAPK1TDP1
SCHEMBL9880794 0.86 KDM4E (0.59) KDM4EHTTKMT2AMAPK1TDP1
SCHEMBL12112351 0.84 LMNA (0.43) KDM4EHTTKMT2AMAPK1TDP1
SCHEMBL12787493 0.82 PPARG (0.54) KDM4EHTTKMT2AMAPK1TDP1
SCHEMBL12112358 0.81 MAPT (0.43) KDM4EMAPK1TDP1
SCHEMBL16994292 0.81 PPARA (0.41) KDM4EKMT2AMAPK1TDP1
SCHEMBL15946555 0.81 HTT (0.65) RARBHTTTP53TSHRPLA2G4B
SCHEMBL15946519 0.80 HTT (0.68) RARBHTTTP53TSHRPLA2G4B
SCHEMBL12112365 0.80 CA9 (0.48)
SCHEMBL121204 0.79 KDM4E (0.55) RARBKDM4ETP53TSHRPLA2G4B

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-9388259-B2 Photosensitive polymer and photoalignable phase difference film JNC CORPORATION (JP) 2016-07-12 US disclosed
US-20140225047-A1 PHOTOSENSITIVE POLYMER AND PHOTOALIGNABLE PHASE DIFFERENCE FILM JNC PETROCHEMICAL CORPORATION (JP) 2014-08-14 US disclosed