SCHEMBL1774294

SCHEMBL1774294

O=C(O)N1CCC(c2nc(C#CCc3ccccc3)cs2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 12/20 0.39
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CHRM4 P08173 1/20 0.36

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
SCHEMBL1774898 0.86 GAA (0.48) FAAHLMNASMN1; SMN2
SCHEMBL1773617 0.79 FAAH (0.41) FAAH
SCHEMBL1774582 0.79 FAAH (0.37) FAAH
SCHEMBL20541800 0.79 GAA (0.48) FAAHALDH1A1POLBCYP1A2MAPT
SCHEMBL1773538 0.78 FAAH (0.37) FAAHALDH1A1TSHRHTTNPSR1
SCHEMBL1773839 0.78 POLB (0.44) ALDH1A1POLBMEN1CYP1A2CYP3A4
SCHEMBL1774781 0.78 AOC3 (0.50) FAAHALDH1A1POLBMEN1CYP1A2
SCHEMBL1774940 0.77 GRM5 (0.50) FAAHCYP1A2
SCHEMBL20542304 0.76 RBP4 (0.35) FAAHALDH1A1POLBMEN1MAPT
SCHEMBL20542689 0.76 NPC1 (0.45) FAAHALDH1A1MEN1CYP1A2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943774-B2 Heterocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2011-05-17 US disclosed
US-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2010-06-03 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-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents CYP8B1, CYP51A1, HPD FAAH 4083/4885ALDH1A1 1563/4885POLB 4164/4885

“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.