SCHEMBL11690239

SCHEMBL11690239

CCS(=O)(=O)C(O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GMNN O75496 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
PMP22 Q01453 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.41
PSIP1 O75475 1/20 0.41
SRC P12931 1/20 0.41
BCAT2 O15382 1/20 0.40
AOC3 Q16853 2/20 0.39
HSD11B1 P28845 1/20 0.39
APAF1 O14727 1/20 0.39

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
SCHEMBL10452512 0.89 LMNA (0.34) LMNACYP2C19ALDH1A1KMT2AKDM4E
SCHEMBL10452948 0.85 PGK1 (0.41) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL9574373 0.80 TSHR (0.39) LMNACYP2C19ALDH1A1NPSR1PSIP1
SCHEMBL11435568 0.79 ALDH1A1 (0.52) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL1557762 0.77 ALDH1A1 (0.47) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL27962496 0.76 POLB (0.46) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL5133327 0.76 SRC (0.48) LMNACYP2C19ALDH1A1KMT2ANPSR1
SCHEMBL12305030 0.76 CYP2C19 (0.44) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL28254999 0.75 SRC (0.62) LMNACYP2C19ALDH1A1POLBKMT2A
SCHEMBL332354 0.75 ALDH1A1 (0.59) LMNACYP2C19ALDH1A1POLBKMT2A

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-4053373-A ELECTROPLATING OF NICKEL, COBALT, NICKEL-COBALT, NICKEL-IRON, COBALT-IRON AND NICKEL-IRON-COBALT DEPOSITS M & T CHEMICALS INC. (US) 1977-10-11 US claimed