SCHEMBL1815234

SCHEMBL1815234

Cc1cc(Nc2c(C)cccc2C(=O)O)n(-c2ccccc2C)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
MAPT P10636 2/20 0.50
HTT P42858 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GFER P55789 2/20 0.49
GAA P10253 3/20 0.47
NTRK1 P04629 2/20 0.47
POLB P06746 1/20 0.47
FTO Q9C0B1 1/20 0.46
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPK13 O15264 1/20 0.44
MAPK12 P53778 1/20 0.44
MAPK11 Q15759 1/20 0.44
MAPK14 Q16539 1/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL1810794 0.90 GFER (0.44) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1819141 0.89 GFER (0.58) LMNAMAPTHTTGFERGAA
SCHEMBL1814089 0.89 MAPT (0.44) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1816694 0.88 ALDH1A1 (0.47) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1808088 0.88 KMT2A (0.48) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL3307070 0.85 LMNA (0.46) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1814490 0.84 KMT2A (0.47) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1816111 0.84 KMT2A (0.47) LMNAMAPTHTTL3MBTL1GFER
SCHEMBL1811819 0.83 KMT2A (0.46) LMNAMAPTHTTGFERGAA
SCHEMBL5310758 0.82 SMN1; SMN2 (0.46) LMNAMAPTHTTGFERGAA

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
EP-2321296-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2011-05-18 EP disclosed
US-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-22 US disclosed
WO-2010020363-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-25 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-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF CYP3A5, ABAT, TPMT LMNA 4322/4885MAPT 2724/4885HTT 3044/4885

“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.