SCHEMBL10189697

SCHEMBL10189697

CCc1cc(-c2nn[nH]c2-c2ccc(I)cc2)c(O)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNIK Q9UKE5 2/20 0.38
HSP90AA1 P07900 11/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
HSP90AB1 P08238 5/20 0.36
MAPT P10636 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
MET P08581 1/20 0.36
PIM1 P11309 1/20 0.36
LTK P29376 1/20 0.36
GAA P10253 4/20 0.36
HPGD P15428 2/20 0.34
ALOX12 P18054 2/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NPY1R P25929 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL10189793 0.91 LTB4R (0.37) HSP90AA1MEN1KMT2AHSP90AB1MAPT
SCHEMBL10189792 0.89 HSP90AA1 (0.39) HSP90AA1MEN1KMT2AHSP90AB1MAPT
SCHEMBL10189794 0.89 HSP90AA1 (0.36) TNIKHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL10189722 0.87 MEN1 (0.51) HSP90AA1MEN1KMT2AHSP90AB1MAPT
SCHEMBL10189795 0.86 PIK3CA (0.36) TNIKHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL407992 0.84 MEN1 (0.48) TNIKHSP90AA1MEN1KMT2AHSP90AB1
SCHEMBL412493 0.78 MEN1 (0.47) HSP90AA1MEN1KMT2AHSP90AB1MAPT
SCHEMBL14847319 0.78 TNIK (0.36) TNIK
SCHEMBL412707 0.77 MEN1 (0.48) HSP90AA1MEN1KMT2AHSP90AB1MAPT
SCHEMBL412079 0.75 TNIK (0.36) TNIK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9175022-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2015-11-03 US disclosed
US-8501790-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-08-06 US disclosed
US-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-01-26 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-20120022118-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 TNIK 4158/4885HSP90AA1 289/4885MEN1 1571/4885

“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.