SCHEMBL14803776

SCHEMBL14803776

COC(C(=O)Nc1cnccc1C(C)(C)C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.53
▸ GAA P10253 2/20 0.53
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ KMT2A Q03164 3/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ METAP2 P50579 1/20 0.44
▸ GLS O94925 4/20 0.43
▸ LMNA P02545 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
SCHEMBL14803886 0.85 POLB (0.50) ALDH1A1L3MBTL1NPSR1KMT2ASMN1; SMN2
SCHEMBL14818785 0.83 ALDH1A1 (0.57) ALDH1A1GAAL3MBTL1NPSR1KMT2A
SCHEMBL14803773 0.73 GAA (0.42) ALDH1A1GAAKMT2ASMN1; SMN2MEN1
SCHEMBL13748300 0.72 NAMPT (0.47) GAALMNA
SCHEMBL12341052 0.71 MEN1 (0.42) ALDH1A1GAAKMT2AMEN1KDM4E
SCHEMBL8049390 0.70 ALDH1A1 (0.77) ALDH1A1GAAL3MBTL1KMT2ASMN1; SMN2
SCHEMBL38664985 0.68 LMNA (0.48) ALDH1A1GAAL3MBTL1KMT2ASMN1; SMN2
SCHEMBL14664146 0.68 ALDH1A1 (0.53) ALDH1A1GAAL3MBTL1NPSR1KMT2A
SCHEMBL13434151 0.68 ALDH1A1 (0.64) ALDH1A1GAAL3MBTL1NPSR1KMT2A
SCHEMBL8907510 0.68 ALDH1A1 (0.53) ALDH1A1GAAL3MBTL1NPSR1KMT2A

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-9169246-B2 Pyrazoloquinolinone derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2015-10-27 — — US disclosed
US-20140235616-A1 PYRAZOLOQUINOLINONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2014-08-21 — — US disclosed
US-20130079337-A1 PYRAZOLOQUINOLINONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-03-28 — — 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 (2 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-20130079337-A1 PYRAZOLOQUINOLINONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF CYP11B2, COQ8A, CYP1A2 ALDH1A1 88/4885GAA 1467/4885L3MBTL1 4514/4885
US-20140235616-A1 PYRAZOLOQUINOLINONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF CYP11B2, CYP1A2, COQ8A ALDH1A1 97/4885GAA 1631/4885L3MBTL1 4476/4885

“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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