SCHEMBL21114641

SCHEMBL21114641

COc1ccccc1C(=O)N=Nc1ccc([SiH3])c(N=NC(=O)c2ccccc2OC)c1N=NC(=O)c1ccccc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
LMNA P02545 3/20 0.45
MAPT P10636 3/20 0.45
MCL1 Q07820 1/20 0.45
RAB9A P51151 3/20 0.40
NPC1 O15118 3/20 0.40
CTSD P07339 1/20 0.39
HPGD P15428 1/20 0.38
STAT3 P40763 1/20 0.38
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
BLM P54132 1/20 0.37
UBE2I P63279 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
UBA2 Q9UBT2 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL21114553 0.86 HCRTR1 (0.43) ALDH1A1LMNAMAPTRAB9AHPGD
SCHEMBL21114705 0.86 IRAK4 (0.46) ALDH1A1LMNAMAPTMCL1RAB9A
SCHEMBL21114645 0.77 PRSS1 (0.35) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL21114540 0.77 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL20981427 0.74 CTSD (0.50) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL21114675 0.72 CTSD (0.45) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL21114687 0.70 CTSD (0.46) ALDH1A1MAPTRAB9ANPC1CTSD
SCHEMBL21114699 0.69 CTSD (0.49) ALDH1A1RAB9ANPC1CTSDHPGD
SCHEMBL3261986 0.68 HPGD (0.49) ALDH1A1LMNAMAPTRAB9ANPC1
SCHEMBL13341649 0.67 ABCG2 (0.50) ALDH1A1MAPTRAB9ANPC1CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954361-B2 Curing agent for silicone rubber compounds NITROCHEMIE ASCHAU GMBH (DE) 2021-03-23 US claimed
EP-3484897-B1 HARDENER FOR SILICONE RUBBER MASSES NITROCHEMIE GMBH (DE) 2020-12-23 EP claimed
EP-3484970-B1 COMPOSITION FOR SILICONE RUBBER MASSES NITROCHEMIE GMBH (DE) 2020-07-08 EP claimed
US-20190211187-A1 CURING AGENT FOR SILICONE RUBBER COMPOUNDS NITROCHEMIE ASCHAU GMBH (DE) 2019-07-11 US claimed
US-20210324195-A1 Composition for Silicone Rubber Masses NITROCHEMIE ASCHAU GMBH (DE) 2021-10-21 US disclosed
US-10954361-B2 Curing agent for silicone rubber compounds NITROCHEMIE ASCHAU GMBH (DE) 2021-03-23 US disclosed
US-20190211187-A1 CURING AGENT FOR SILICONE RUBBER COMPOUNDS NITROCHEMIE ASCHAU GMBH (DE) 2019-07-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10954361-B2 Curing agent for silicone rubber compounds CARM1, PRMT1, SRRM2 ALDH1A1 1173/4885LMNA 678/4885MAPT 2135/4885
US-20190211187-A1 CURING AGENT FOR SILICONE RUBBER COMPOUNDS CARM1, PRMT1, SRRM2 ALDH1A1 1173/4885LMNA 678/4885MAPT 2135/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.