SCHEMBL4358158

SCHEMBL4358158

NCc1cc2ccccc2nc1Cl

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
ALDH1A1 P00352 3/20 0.46
MAPT P10636 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
ACHE P22303 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PDE10A Q9Y233 1/20 0.45
TLR8 Q9NR97 3/20 0.44
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.42
PNMT P11086 1/20 0.42
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.40
HTR3A P46098 1/20 0.40
GFER P55789 1/20 0.39

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
SCHEMBL30162631 0.82 KMT2A (1.00) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL377259 0.82 KMT2A (1.00) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL3387991 0.82 KMT2A (0.62) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL29518150 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL8735682 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL120913 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL681071 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL13067261 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTGLAHPGD
SCHEMBL21550243 0.79 KMT2A (0.44) KMT2AALDH1A1MAPTNPSR1LOXL2
SCHEMBL317874 0.78 TLR8 (0.62) KMT2AALDH1A1MAPTGLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1961733-B1 METHOD FOR SELECTIVELY PRODUCING PRIMARY AMINE COMPOUND SUMITOMO CHEMICAL CO (JP) 2014-08-20 EP disclosed
CN-103102303-A Benzylamine derivatives as CETP inhibitors REDDY US THERAPEUTICS INC 2013-05-15 CN disclosed
US-8269044-B2 Method for selectively producing primary amine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-18 US disclosed
US-20090281325-A1 METHOD FOR SELECTIVELY PRODUCING PRIMARY AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-12 US disclosed
EP-1961733-A1 METHOD FOR SELECTIVELY PRODUCING PRIMARY AMINE COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-08-27 EP 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 (1 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-20090281325-A1 METHOD FOR SELECTIVELY PRODUCING PRIMARY AMINE COMPOUND NAT1, AADAC, AOC3 KMT2A 351/4885ALDH1A1 153/4885MAPT 2344/4885

“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.