SCHEMBL5981996

SCHEMBL5981996

CCNc1ccc(C)cc1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
KMT2A Q03164 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 5/20 0.49
HPGD P15428 4/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 2/20 0.45
RAB9A P51151 7/20 0.44
NPC1 O15118 5/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
MAPK1 P28482 1/20 0.43
MEN1 O00255 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL14044063 0.83 TSHR (0.41) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL13793862 0.81 STAT3 (0.43) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL11230528 0.79 KDM4E (0.48) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL8348988 0.78 RAPGEF4 (0.52) KMT2AL3MBTL1MAPTHPGDALDH1A1
SCHEMBL1465687 0.78 RAB9A (0.49) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL31544733 0.78 SMN1; SMN2 (0.41) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL12852098 0.78 SMN1; SMN2 (0.41) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL3631632 0.78 KMT2A (0.40) KDM4EKMT2APOLBMAPTHPGD
SCHEMBL26378132 0.77 KDM4E (0.47) KDM4EKMT2AL3MBTL1POLBMAPT
SCHEMBL27645827 0.76 MEN1 (0.43) KMT2AL3MBTL1POLBMAPTHPGD

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
WO-2006060654-A2 PESTICIDAL COMPOSITIONS AND METHODS DIVERGENCE, INC. (US) 2006-06-08 WO claimed
US-20050203067-A1 Pesticidal compositions and methods DIVERGENCE, INC. 2005-09-15 US claimed
WO-2006060654-A2 PESTICIDAL COMPOSITIONS AND METHODS DIVERGENCE, INC. (US) 2006-06-08 WO disclosed
US-20050203067-A1 Pesticidal compositions and methods DIVERGENCE, INC. 2005-09-15 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-20050203067-A1 Pesticidal compositions and methods ACHE, DDT, PTMS KDM4E 2536/4885KMT2A 2382/4885L3MBTL1 1311/4885

“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.