SCHEMBL14407352

SCHEMBL14407352

CCCCCC(CCCCC(=O)OC)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.54
PPARA Q07869 1/20 0.51
CNR2 P34972 1/20 0.48
EPHX2 P34913 1/20 0.47
BIRC2 Q13490 1/20 0.46
CSNK1E P49674 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC3 O15379 4/20 0.45
HDAC1 Q13547 4/20 0.45
HDAC2 Q92769 4/20 0.45
HDAC8 Q9BY41 4/20 0.45
HDAC6 Q9UBN7 4/20 0.45
HDAC4 P56524 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL27650570 0.84 FFAR4 (0.54) PPARGPPARACSNK1EMEN1KMT2A
SCHEMBL27650627 0.84 FFAR4 (0.54) PPARGPPARACSNK1EMEN1KMT2A
Diphenylmethane SCHEMBL27590149 0.82 LTA4H (0.54) PPARGPPARAEPHX2MEN1KMT2A
SCHEMBL14780164 0.82 CSNK1E (0.57) CNR2CSNK1E
SCHEMBL21879789 0.81 CPA3 (0.55) CSNK1EHDAC3HDAC1HDAC2HDAC8
Ethylbenzene SCHEMBL27994630 0.81 EPHX2 (0.56) PPARGPPARACNR2EPHX2MEN1
Dimethylamine SCHEMBL20994614 0.81 HDAC3 (0.52) HDAC3HDAC1HDAC2HDAC8HDAC6
Bicarbonate SCHEMBL28434600 0.81 CSNK1E (0.58) CNR2EPHX2CSNK1E
SCHEMBL9250262 0.80 EPHX2 (0.47) CNR2EPHX2CSNK1EMEN1KMT2A
SCHEMBL27435590 0.80 MMP2 (0.49) PPARGCSNK1ELMNA

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-7270928-B2 Isocyanate composition, microcapsule and production method thereof, and recording material FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed
US-7270928-B2 Isocyanate composition, microcapsule and production method thereof, and recording material FUJIFILM CORPORATION (JP) 2007-09-18 US disclosed