SCHEMBL30342247

SCHEMBL30342247

CN(C)c1ccccc1N=Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 8/20 0.55
MAPK1 P28482 7/20 0.55
ALDH1A1 P00352 3/20 0.55
TSHR P16473 3/20 0.55
HSD17B10 Q99714 2/20 0.55
MEN1 O00255 9/20 0.49
KMT2A Q03164 9/20 0.49
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.49
ALPL P05186 1/20 0.49
ALPI P09923 1/20 0.49
ALPG P10696 1/20 0.49
MYC P01106 1/20 0.47
MAPT P10636 7/20 0.44
L3MBTL1 Q9Y468 4/20 0.44
CASP3 P42574 4/20 0.42
SENP7 Q9BQF6 4/20 0.42
SENP6 Q9GZR1 4/20 0.42
SENP8 Q96LD8 3/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL28313589 1.00 TDP1 (0.55) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL187588 1.00 TDP1 (0.55) TDP1MAPK1ALDH1A1TSHRHSD17B10
Hydrogen Sulfide SCHEMBL28338492 0.98 TDP1 (0.53) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL29747008 0.98 MAPK1 (0.53) TDP1MAPK1ALDH1A1TSHRHSD17B10
Isothiocyanate SCHEMBL8352965 0.89 TDP1 (0.46) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL8619132 0.89 MEN1 (0.46) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL27468058 0.89 MYC (0.48) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL8722208 0.89 MAPT (0.48) TDP1MAPK1ALDH1A1TSHRHSD17B10
Formic Acid Methyl Ester SCHEMBL28234545 0.87 MAPK1 (0.43) TDP1MAPK1ALDH1A1TSHRHSD17B10
SCHEMBL6536926 0.83 KMT2A (0.61) TDP1MAPK1ALDH1A1TSHRHSD17B10

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3655487-B1 FILLER BOND COMPOSITION INDICATING READINESS TO SAND ILLINOIS TOOL WORKS (US) 2024-09-04 EP disclosed
WO-2024107375-A1 MARINE REPAIR COMPOSITION ILLINOIS TOOL WORKS INC. (US) 2024-05-23 WO disclosed
US-20230104052-A1 FILLER COMPOSITION INDICATING READINESS TO SAND ILLINOIS TOOL WORKS INC. (US) 2023-04-06 US disclosed