SCHEMBL6490665

SCHEMBL6490665

Cn1nccc1OC(=O)c1ccc(Cl)c(Cn2cnnn2)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.35
TP53 P04637 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.32
STAT5B P51692 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30
ALOX12 P18054 1/20 0.30
RECQL P46063 1/20 0.30
HBB P68871 1/20 0.30
HSD17B10 Q99714 1/20 0.30
RORC P51449 1/20 0.30
F10 P00742 1/20 0.30

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
SCHEMBL6491274 0.83 MAPK1 (0.36) MAPK1TP53MEN1KMT2AMAPT
SCHEMBL6488316 0.82 POLB (0.34) POLBRORCF10
SCHEMBL6489376 0.81 TP53 (0.43) MAPK1TP53MEN1KMT2AMAPT
SCHEMBL6483486 0.79 MEN1 (0.30) MEN1KMT2ACYP1A2CYP2C9
SCHEMBL6492717 0.76 MAPK1 (0.41) MAPK1TP53MEN1KMT2ACYP1A2
SCHEMBL6481316 0.76 MAPK1 (0.41) MAPK1TP53MEN1KMT2AMAPT
SCHEMBL6482302 0.75 MAPK1 (0.33) MAPK1TP53MEN1KMT2ACYP1A2
SCHEMBL6481693 0.75 MAPK1 (0.35) MAPK1TP53MEN1KMT2AMAPT
SCHEMBL20010413 0.73 KAT7 (0.34) MEN1KMT2A
SCHEMBL6829938 0.71 RORC (0.30) RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050222247-A1 Chroman derivatives BAYER HEALTHCARE AG (DE) 2005-10-06 US disclosed
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 (2 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-20050222247-A1 Chroman derivatives CHRM3, CHRNB3, ADRB3 MAPK1 1288/4885TP53 3292/4885MEN1 3364/4885
US-20050090398-A1 Novel tetrazole derivative useful as herbicides DDT, TTI1, CYP1A1 MAPK1 2914/4885TP53 1908/4885MEN1 2766/4885

“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.