SCHEMBL27947435

SCHEMBL27947435

CC=CC(=O)c1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.58
MAPT P10636 8/20 0.54
RAB9A P51151 3/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
NPC1 O15118 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
CYP1B1 Q16678 4/20 0.45
RECQL P46063 2/20 0.44
THRB P10828 2/20 0.44
THRA P10827 1/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
ALDH1A1 P00352 5/20 0.43
LMNA P02545 3/20 0.43
MAOB P27338 3/20 0.43
TNFRSF1A P19438 2/20 0.43

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
SCHEMBL27947433 1.00 TRPA1 (0.58) TRPA1MAPTRAB9ACASP3SENP8
SCHEMBL3412403 0.82 RECQL (0.61) MAPTRAB9ANPC1SMN1; SMN2CYP1B1
SCHEMBL314323 0.82 RECQL (0.61) MAPTRAB9ANPC1SMN1; SMN2CYP1B1
SCHEMBL314324 0.82 RECQL (0.61) MAPTRAB9ANPC1SMN1; SMN2CYP1B1
SCHEMBL21065368 0.79 ALDH1A1 (0.56) MAPTRAB9AL3MBTL1NPC1SMN1; SMN2
SCHEMBL28111089 0.78 CYP1B1 (0.48) MAPTRAB9AL3MBTL1NPC1SMN1; SMN2
SCHEMBL13450055 0.78 MAPT (0.60) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL28588201 0.75 MAPT (0.53) MAPTRAB9ACASP3SENP8SENP7
SCHEMBL1405427 0.75 MAPT (0.70) TRPA1MAPTRAB9ACASP3SENP8
SCHEMBL18806555 0.75 MAPT (0.70) TRPA1MAPTRAB9ACASP3SENP8

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-103483466-A Preparation method and application of graphene oxide derivative UNIV ZHENGZHOU 2014-01-01 CN disclosed