SCHEMBL9799141

SCHEMBL9799141

CC(=O)N1CCN(C(C)=O)CC1.CCNc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.57
▸ GAA P10253 6/20 0.57
▸ GFER P55789 5/20 0.57
▸ ALOX15 P16050 5/20 0.57
▸ ALOX12 P18054 5/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ KMT2A Q03164 3/20 0.50
▸ KDM4E B2RXH2 4/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ HSP90AA1 P07900 1/20 0.49
▸ HSP90AB1 P08238 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ ERAP1 Q9NZ08 1/20 0.47
▸ LMNA P02545 3/20 0.46

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
Acetic Acid SCHEMBL28291888 0.83 LMNA (0.57) MAPTGAAKMT2AKDM4EALDH1A1
Acetic Acid SCHEMBL28914683 0.81 LMNA (0.55) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL12311337 0.81 KDM1A (0.54) MAPTGAAGFERALOX15ALOX12
Acetic Acid SCHEMBL28914685 0.78 LMNA (0.52) MAPTGAAKMT2AKDM4ETSHR
Urea SCHEMBL8618609 0.77 ADRA2A (0.56) MAPTGAAGFERKDM4EALDH1A1
Bicarbonate SCHEMBL28218650 0.77 LMNA (0.55) MAPTGAAKMT2AKDM4EALDH1A1
Malonic Acid SCHEMBL8978416 0.77 LMNA (0.55) MAPTGAAKMT2AKDM4EALDH1A1
SCHEMBL14590550 0.77 KDM4E (0.71) MAPTGAAMAPK1KMT2AKDM4E
Methyl Alcohol SCHEMBL5316416 0.77 LMNA (0.57) MAPTGAAALDH1A1TSHRHSD17B10
SCHEMBL7709 0.77 — —

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-5051504-A Dyes for coloring paper BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 — — US disclosed
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