SCHEMBL6724664

SCHEMBL6724664

N#Cc1cc(F)c(-n2nc3ccc(Cl)cn3c2=O)cc1SCc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 3/20 0.35
ALDH1A1 P00352 7/20 0.34
NPSR1 Q6W5P4 4/20 0.34
KDM4E B2RXH2 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
TSHR P16473 1/20 0.34
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
XDH P47989 1/20 0.33
CTSB P07858 1/20 0.33
MAPT P10636 3/20 0.33
POLB P06746 2/20 0.33
GAA P10253 2/20 0.33
HPGD P15428 2/20 0.33
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
PPARG P37231 2/20 0.32
NCOA2 Q15596 2/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL6728852 0.81 GPR139 (0.35) ALDH1A1KDM4ETDP1
SCHEMBL6724485 0.81 GPR139 (0.34) ALDH1A1KDM4EGAATDP1
SCHEMBL7014884 0.78 GPR139 (0.34) ALDH1A1KDM4ESMN1; SMN2GAAHPGD
SCHEMBL6730520 0.76 S1PR3 (0.36) KMT2AMEN1
SCHEMBL6729658 0.76 ALDH1A1 (0.38) ALDH1A1L3MBTL1MAPTPOLBMAPK1
SCHEMBL6729888 0.75 ACLY (0.32) ALDH1A1KMT2AMEN1
SCHEMBL6735913 0.74 BCAT2 (0.33) KMT2A
SCHEMBL6724560 0.73 PPOX (0.35) ALDH1A1KDM4ETSHRGAAHPGD
SCHEMBL6729050 0.73 PGR (0.37)
SCHEMBL6724492 0.73 GPR139 (0.35)

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-20040063580-A1 Bicyclic triazolone derivatives and a herbicides containing the same SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2004-04-01 US disclosed
EP-1333031-A1 BICYCLIC TRIAZOLONE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 EP 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-20040063580-A1 Bicyclic triazolone derivatives and a herbicides containing the same WEE1, WEE2, BAK1 RXFP1 1251/4885ALDH1A1 318/4885NPSR1 1374/4885

“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.