SCHEMBL13623004

SCHEMBL13623004

CC(C)(C)OC(=O)Nc1cccc(CNC(=O)c2cccc([N+](=O)[O-])c2)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SENP5 Q96HI0 2/20 0.54
SENP2 Q9HC62 2/20 0.54
SENP1 Q9P0U3 2/20 0.54
ALDH1A1 P00352 7/20 0.53
MAPT P10636 5/20 0.53
LMNA P02545 4/20 0.53
HPGD P15428 5/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
POLB P06746 1/20 0.51
BLM P54132 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ALOX5 P09917 1/20 0.50
GAA P10253 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
SCHEMBL13623192 0.86 MEN1 (0.50) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL13622963 0.86 MEN1 (0.67) SENP1ALDH1A1MAPTLMNAHPGD
SCHEMBL10160157 0.85 SENP1 (0.55) SENP5SENP2SENP1ALDH1A1MAPT
SCHEMBL1024073 0.84 ALDH1A1 (0.61) SENP5SENP2SENP1ALDH1A1MAPT
SCHEMBL1024076 0.84 ALDH1A1 (0.61) SENP5SENP2SENP1ALDH1A1MAPT
SCHEMBL13623066 0.83 MAPT (0.50) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL13623005 0.83 SENP1 (0.52) SENP5SENP2SENP1ALDH1A1LMNA
SCHEMBL13670025 0.82 ALDH1A1 (0.60) SENP5SENP2SENP1ALDH1A1MAPT
SCHEMBL7075396 0.82 MEN1 (0.73) ALDH1A1MAPTLMNAHPGDMEN1
SCHEMBL3222110 0.82 SMN1; SMN2 (0.64) ALDH1A1MAPTLMNAHPGDMEN1

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-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 WO 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK SENP5 2914/4885SENP2 3357/4885SENP1 2867/4885

“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.