SCHEMBL6481065

SCHEMBL6481065

Cc1nnn(Cc2c(Cl)ccc(C(=O)O)c2Cl)n1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 0.37
ENPP2 Q13822 8/20 0.37
BUB1 O43683 1/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.34
NR4A1 P22736 1/20 0.34
CTSB P07858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NOTUM Q6P988 1/20 0.34

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
SCHEMBL6490236 0.90 ENPP2 (0.37) ENPP2NPC1RAB9AALDH1A1
SCHEMBL6490664 0.86 BUB1 (0.38) ENPP2BUB1NPC1RAB9ASMN1; SMN2
SCHEMBL6492930 0.84 ENPP2 (0.38) MYCENPP2LMNAPOLB
SCHEMBL6480978 0.77 LMNA (0.38) NPC1RAB9ASMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL6482084 0.77 ENPP2 (0.34) ENPP2BUB1NPC1RAB9A
SCHEMBL16401084 0.76 ENPP2 (0.54) ENPP2
SCHEMBL6494834 0.76 P2RX7 (0.42) MYCBUB1ALDH1A1L3MBTL1LMNA
SCHEMBL6481052 0.76 POLB (0.40) MYCBUB1SMN1; SMN2ALDH1A1POLB
SCHEMBL6491875 0.74 ENPP2 (0.38) ENPP2
SCHEMBL6489698 0.74 ENPP2 (0.37) ENPP2

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-20050090398-A1 Novel tetrazole derivative useful as herbicides YANAGI AKIHIKO (JP) 2005-04-28 US disclosed
EP-1476437-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES Bayer CropScience AG (DE) 2004-11-17 EP disclosed
WO-2003066607-A1 NOVEL TETRAZOLE DERIVATIVE USEFUL AS HERBICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-08-14 WO 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-20050090398-A1 Novel tetrazole derivative useful as herbicides DDT, TTI1, CYP1A1 MYC 2199/4885ENPP2 3742/4885BUB1 1179/4885

“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.