SCHEMBL1609885

SCHEMBL1609885

COC(=O)c1nc(-c2ccc(Cl)cc2)nc(NCc2ccccc2)c1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.57
MAPT P10636 5/20 0.57
MEN1 O00255 5/20 0.57
NPSR1 Q6W5P4 3/20 0.57
ALDH1A1 P00352 2/20 0.57
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C19 P33261 2/20 0.51
PDE5A O76074 2/20 0.51
GAA P10253 2/20 0.51
CYP2C9 P11712 1/20 0.51
F2 P00734 3/20 0.50
RAB9A P51151 1/20 0.49
HPGD P15428 2/20 0.47
USP2 O75604 1/20 0.47
LMNA P02545 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
CCNA2 P20248 1/20 0.46
CDK2 P24941 1/20 0.46

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
SCHEMBL11902751 0.85 CYP1A2 (0.44) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1609559 0.83 PDE5A (0.51) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL120609 0.83 RAB9A (0.54) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1654721 0.78 CYP1A2 (0.43) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1609704 0.77 PDE10A (0.62) NPSR1ALDH1A1CYP1A2CYP3A4CYP2C19
SCHEMBL1653951 0.76 ALDH1A1 (0.43) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1609680 0.75 MAPT (0.47) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1609024 0.75 MAPT (0.57) KMT2AMAPTMEN1NPSR1ALDH1A1
SCHEMBL1610447 0.75 KDM4E (0.43) MAPTNPSR1ALDH1A1RAB9AHPGD
SCHEMBL1609147 0.75 PDE10A (0.50) KMT2AMAPTMEN1NPSR1ALDH1A1

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
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
US-20110086759-A1 CHEMICAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2011-04-14 US disclosed
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 KMT2A 2003/4885MAPT 2800/4885MEN1 3860/4885

“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.