SCHEMBL4883667

SCHEMBL4883667

CC(=O)C(C1=CCCCC1=O)C1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.63
MAPT P10636 2/20 0.48
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.36
CYP3A4 P08684 3/20 0.35
ALOX15 P16050 2/20 0.35
CYP2C19 P33261 4/20 0.33
CHRM3 P20309 2/20 0.33
CYP2C9 P11712 3/20 0.33
SLC6A3 Q01959 3/20 0.33
TSHR P16473 1/20 0.33
DHODH Q02127 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
GSTP1 P09211 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
SCHEMBL4112082 0.78 HIF1A (1.00) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL4112077 0.78 HIF1A (1.00) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL4119830 0.76 HIF1A (0.97) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL4119826 0.76 HIF1A (0.97) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL12056719 0.68 HIF1A (0.56) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL6548167 0.67 HIF1A (0.50) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL9809565 0.66 CHRM3 (0.61) MAPTTP53CYP3A4CHRM3SLC6A3
SCHEMBL13043858 0.65 HIF1A (0.53) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL4120017 0.65 HIF1A (0.53) HIF1AMAPTTP53THRBCYP3A4
SCHEMBL7887806 0.64 HIF1A (0.47) HIF1AMAPTTP53THRBCYP3A4

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
US-20080131812-A1 Resin for printing plate material and lithographic printing plate material by use thereof KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2008-06-05 US disclosed