SCHEMBL6509732

SCHEMBL6509732

Cn1c(=O)n(Cc2ccc(Cl)cc2)c(=O)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
TSHR P16473 2/20 0.60
KMT2A Q03164 2/20 0.60
HDAC1 Q13547 1/20 0.59
MAPT P10636 3/20 0.56
MAPK8 P45983 2/20 0.54
MAPK9 P45984 2/20 0.54
SLC9A1 P19634 1/20 0.53
TP53 P04637 2/20 0.51
ERCC1 P07992 1/20 0.50
FEN1 P39748 1/20 0.50
ERCC4 Q92889 1/20 0.50
THRB P10828 1/20 0.50
UBE2N P61088 1/20 0.49

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
SCHEMBL17241665 0.90 MAPT (0.56) MEN1TSHRKMT2AHDAC1MAPT
SCHEMBL19555085 0.89 MAPK8 (0.66) HDAC1MAPTMAPK8MAPK9SLC9A1
SCHEMBL17241596 0.88 TSHR (0.62) MEN1TSHRKMT2AHDAC1MAPT
SCHEMBL24004722 0.86 TSHR (0.76) MEN1TSHRKMT2AHDAC1MAPT
SCHEMBL6466889 0.85 P2RX4 (0.64) MEN1KMT2AHDAC1MAPT
SCHEMBL3556560 0.83 HDAC1 (0.67) HDAC1MAPK8MAPK9TP53THRB
SCHEMBL6510739 0.82 KMT2A (0.72) MEN1KMT2AHDAC1MAPTMAPK8
SCHEMBL10084710 0.82 MEN1 (0.52) MEN1KMT2AMAPTTP53THRB
SCHEMBL6396627 0.81 PARG (0.47) HDAC1MAPTMAPK8MAPK9THRB
SCHEMBL1058355 0.80 HDAC1 (0.66) HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004126-A1 Method of determining potential allosterically-binding matrix metalloproteinase inhibitors ANDRIANJARA CHARLES (FR) 2005-01-06 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-20050004126-A1 Method of determining potential allosterically-binding matrix metalloproteinase inhibitors MMP13, MMP12, MMP25 MEN1 1184/4885TSHR 1662/4885KMT2A 2962/4885

“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.