SCHEMBL28062161

SCHEMBL28062161

CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC.Oc1ccc(O)c(O)c1O

nearest known ligand 0.82

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.82
TSHR P16473 4/20 0.82
LMNA P02545 1/20 0.82
CYP3A4 P08684 2/20 0.79
MAPK1 P28482 2/20 0.79
TP53 P04637 1/20 0.79
TDP1 Q9NUW8 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.71
HSD17B10 Q99714 2/20 0.67
KDM4E B2RXH2 2/20 0.67
POLB P06746 1/20 0.67
ESR1 P03372 1/20 0.57
AKR1C4 P17516 1/20 0.57
AKR1C3 P42330 1/20 0.57
AKR1C2 P52895 1/20 0.57
AKR1C1 Q04828 1/20 0.57
KDM4A O75164 1/20 0.57
KDM4C Q9H3R0 1/20 0.57

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
Pyrogallol SCHEMBL27262321 0.93 ALDH1A1 (0.79) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL27481795 0.92 ALDH1A1 (0.90) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL27687278 0.91 ALDH1A1 (0.77) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL4210493 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL2472738 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL5072881 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL81945 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL7219181 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL2527136 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1
SCHEMBL6245568 0.91 ALDH1A1 (1.00) ALDH1A1TSHRLMNACYP3A4MAPK1

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
CN-105511227-A Dry film resist with good hole shielding function and laminated body thereof HANGZHOU FIRST PV MAT CO LTD 2016-04-20 CN disclosed