SCHEMBL1610213

SCHEMBL1610213

COC(=O)c1nc(C2CC2)nc(NC2(C=Cc3ccc(Cl)cc3Cl)CC2)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
GLA P06280 1/20 0.35
MCHR1 Q99705 1/20 0.34
S1PR4 O95977 1/20 0.34
CNR2 P34972 1/20 0.34
KDM4E B2RXH2 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33

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
SCHEMBL1610209 1.00 SLC6A3 (0.37) SLC6A3MEN1KMT2ANPC1RAB9A
SCHEMBL1609521 0.90 KMT2A (0.37) SLC6A3MEN1KMT2ANPC1RAB9A
SCHEMBL1609520 0.90 KMT2A (0.37) SLC6A3MEN1KMT2ANPC1RAB9A
SCHEMBL1610682 0.87 SLC6A3 (0.39) SLC6A3MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL1610679 0.87 SLC6A3 (0.39) SLC6A3MEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL1609935 0.87 SLC6A3 (0.35) SLC6A3RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL1609934 0.87 SLC6A3 (0.35) SLC6A3RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL1610535 0.86 POLB (0.31) RAB9APOLBMAPT
SCHEMBL1610532 0.86 POLB (0.31) RAB9APOLBMAPT
SCHEMBL1611866 0.85 NPC1 (0.38) SLC6A3MEN1KMT2ANPC1RAB9A

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-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 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 (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-20110086759-A1 CHEMICAL COMPOUNDS DDT, PNPO, CBR3 SLC6A3 2437/4885MEN1 3860/4885KMT2A 2003/4885

“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.