SCHEMBL9922266

SCHEMBL9922266

CN1C(=O)Cc2cc(I)ccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 2/20 0.51
CASP3 P42574 3/20 0.45
APP P05067 2/20 0.44
SRD5A1 P18405 1/20 0.38
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CASP6 P55212 3/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
ADRA2A P08913 1/20 0.36
PNMT P11086 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36

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
SCHEMBL9918979 0.81 METAP1 (0.50) CASP3APPSRD5A1KMT2AALDH1A1
SCHEMBL12706597 0.79 RAB9A (0.44) TDP2KMT2AALDH1A1MEN1MAPT
SCHEMBL9918982 0.79 SRD5A1 (0.50) TDP2SRD5A1KMT2AMEN1CASP6
SCHEMBL19657308 0.79 CASP3 (0.43) TDP2CASP3SRD5A1KMT2AALDH1A1
SCHEMBL16506973 0.79 TRIM24 (0.49) CASP3KMT2AALDH1A1MEN1GAA
SCHEMBL9922246 0.77 ALDH1A1 (0.60) APPKMT2AALDH1A1MEN1MAPT
SCHEMBL9922257 0.77 METAP1 (0.55) CASP3APPKMT2AALDH1A1MEN1
SCHEMBL9922248 0.77 APP (0.41) TDP2APPKMT2AALDH1A1MEN1
SCHEMBL9918985 0.76 ALDH1A1 (0.64) APPKMT2AALDH1A1MEN1MAPT
SCHEMBL17322371 0.76 MAPT (0.62) TDP2KMT2AALDH1A1MAPTGAA

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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-06-14 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-20120149688-A1 PLATELET ADP RECEPTOR INHIBITORS TBXA2R, GP6, P2RY6 TDP2 2409/4885CASP3 2695/4885APP 3844/4885

“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.