SCHEMBL1610550

SCHEMBL1610550

C=CCN(Cc1cc(Cl)ccc1OC)c1nc(C2CC2)nc(C(=O)OC)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.37
STAT3 P40763 1/20 0.37
S1PR4 O95977 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
NLRP3 Q96P20 1/20 0.35
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 1/20 0.33
NPC1 O15118 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
SCHEMBL13769417 0.86 LTC4S (0.34) ALDH1A1MEN1KMT2A
SCHEMBL1609974 0.86 MEN1 (0.43) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL1609999 0.83 ALOX5 (0.34) ALDH1A1MAPTTSHR
SCHEMBL12713205 0.83 ALDH1A1 (0.34) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL1609969 0.83 CHRM3 (0.38) ALDH1A1MAPTTSHRNPSR1KDM4E
SCHEMBL1610486 0.81 SMN1; SMN2 (0.34) ALDH1A1MEN1KMT2A
SCHEMBL1609271 0.80 KLKB1 (0.34) ALDH1A1KMT2A
SCHEMBL1609106 0.80 TRPM8 (0.37) ALDH1A1TDP1MAPTTSHRNPSR1
SCHEMBL1610065 0.76 SMN1; SMN2 (0.37) ALDH1A1MAPTTHRBKDM4EMEN1
SCHEMBL1610169 0.74 CHRM3 (0.37) ALDH1A1MAPTTSHRNPSR1KDM4E

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 ALDH1A1 1562/4885TDP1 344/4885STAT3 3880/4885

“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.