SCHEMBL2491789

SCHEMBL2491789

NC(=O)CCc1ccccc1C(=O)S

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.46
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.44
MTNR1A P48039 1/20 0.40
MPO P05164 2/20 0.39
EGFR P00533 1/20 0.37
SRC P12931 1/20 0.37
KMT2A Q03164 1/20 0.37
CAPN1 P07384 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ADRB2 P07550 1/20 0.36
NR4A2 P43354 1/20 0.36
IKBKB O14920 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HMGB1 P09429 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL6800544 0.83 FOLH1 (0.61) FOLH1ALDH1A1LMNAMTNR1AKMT2A
SCHEMBL9321175 0.82 MTNR1A (0.47) ALDH1A1LMNAMTNR1AMPOEGFR
SCHEMBL2491792 0.80 KMT2A (0.46) FOLH1ALDH1A1LMNAMTNR1AMPO
SCHEMBL9627316 0.79 MAPT (0.50) FOLH1ALDH1A1LMNAKMT2AMAPT
SCHEMBL3571210 0.79 ALDH1A1 (0.45) FOLH1ALDH1A1LMNAMTNR1AMPO
SCHEMBL9030516 0.77 ALDH1A1 (0.73) ALDH1A1LMNAMTNR1AKMT2AKDM4E
SCHEMBL1900362 0.77 FOLH1 (0.48) FOLH1ALDH1A1LMNAKMT2AADRB2
SCHEMBL21937573 0.76 FOLH1 (0.42) FOLH1ALDH1A1KDM4EMAPTHPGD
SCHEMBL4681236 0.75 CYP4F2 (0.47) ALDH1A1LMNAMTNR1AMPOEGFR
SCHEMBL8967245 0.75 CYP4F2 (0.43) LMNAMTNR1AMPOEGFRSRC

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
JP-2011195453-A IMMUNE-MEASURING REAGENT MORINAGA & CO LTD 2011-10-06 JP disclosed