SCHEMBL13100033

SCHEMBL13100033

CCc1cc(-c2[nH]nc(N)c2-c2ccccc2-c2nnn[nH]2)c(O)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 6/20 0.43
▸ ALOX15 P16050 2/20 0.40
▸ ALOX12 P18054 2/20 0.40
▸ GAA P10253 5/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ ILK Q13418 2/20 0.37
▸ HSP90AB1 P08238 3/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ LMNA P02545 2/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.34
▸ HPGD P15428 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
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HSD17B10 Q99714 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
SCHEMBL1344154 0.89 HSP90AA1 (0.44) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL12046580 0.73 MEN1 (0.54) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL14425303 0.73 HSP90AA1 (0.46) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL1148786 0.71 MEN1 (0.57) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL1344400 0.69 HSP90AA1 (0.38) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL6956747 0.69 TRPA1 (0.41) —
SCHEMBL12060319 0.68 GAA (0.36) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL1147840 0.68 HSP90AA1 (0.46) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL1148187 0.67 MEN1 (0.40) HSP90AA1ALOX15ALOX12GAAMEN1
SCHEMBL14134962 0.67 TRPA1 (0.41) SMN1; SMN2

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
US-8648104-B2 Method for treating proliferative disorders associated with mutations in c-Met SYNTA PHARMACEUTICALS CORP. (US) 2014-02-11 — — US disclosed
US-8648104-B2 Method for treating proliferative disorders associated with mutations in c-Met SYNTA PHARMACEUTICALS CORP. (US) 2014-02-11 — — US disclosed
US-20100273846-A1 METHOD FOR TREATING PROLIFERATIVE DISORDERS ASSOCIATED WITH MUTATIONS IN C-MET LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2010-10-28 — — US disclosed
US-20100273846-A1 METHOD FOR TREATING PROLIFERATIVE DISORDERS ASSOCIATED WITH MUTATIONS IN C-MET LSI FINANCING LLC, AS ADMINISTRATIVE AGENT 2010-10-28 — — 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-20100273846-A1 METHOD FOR TREATING PROLIFERATIVE DISORDERS ASSOCIATED WITH MUTATIONS IN C-MET HSP90AB1, HSP90B1, HSP90AA1 HSP90AA1 3/4885ALOX15 3915/4885ALOX12 4050/4885

“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.

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