SCHEMBL12757296

SCHEMBL12757296

CCOC(=O)C(C)(C)CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC(C)(CC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC)C(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.44
CYP4A11 Q02928 3/20 0.44
PKM P14618 3/20 0.35
MMP8 P22894 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
THRB P10828 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ABCB11 O95342 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
HTR2A P28223 1/20 0.33
PMP22 Q01453 1/20 0.33
PPARA Q07869 1/20 0.33
HTT P42858 1/20 0.33
ALOX15 P16050 1/20 0.32

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
SCHEMBL18232353 1.00 CYP4F2 (0.44) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL12384015 0.96 CYP4F2 (0.47) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL10027503 0.94 CYP4F2 (0.48) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL15180191 0.86 CYP4F2 (0.42) CYP4F2CYP4A11PKMMMP8KDM4E
SCHEMBL13624773 0.86 CYP4F2 (0.47) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL16866713 0.86 CYP4F2 (0.47) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL18961219 0.86 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL15275769 0.84 CYP4F2 (0.39) CYP4F2CYP4A11PKMMMP8ALDH1A1
SCHEMBL17480012 0.84 CYP4F2 (0.38) CYP4F2CYP4A11
SCHEMBL17515306 0.84 CYP4F2 (0.38) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8393724-B2 Maintenance liquid for inkjet recording, ink set and image forming method FUJIFILM CORPORATION (JP) 2013-03-12 US disclosed
US-20130029268-A1 PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF PRODUCING A PLANOGRAPHIC PRINTING PLATE FUJIFILM CORPORATION (JP) 2013-01-31 US disclosed
US-20110074866-A1 MAINTENANCE LIQUID FOR INKJET RECORDING, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2011-03-31 US disclosed
US-20110050795-A1 INK SET AND IMAGE FORMATION METHOD FUJIFILM CORPORATION (JP) 2011-03-03 US disclosed