SCHEMBL10692807

SCHEMBL10692807

O=C(CO)NCc1ccc(Cl)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.68
MEN1 O00255 4/20 0.68
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
ALDH1A1 P00352 4/20 0.62
HPGD P15428 4/20 0.62
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
GAA P10253 1/20 0.60
POLB P06746 1/20 0.55
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA9 Q16790 1/20 0.55
ERCC1 P07992 1/20 0.54
ERCC4 Q92889 1/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 2/20 0.51
THRB P10828 1/20 0.51

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
SCHEMBL11298232 0.85 HPGD (0.68) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL4035227 0.84 KMT2A (0.68) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL16082991 0.84 ALDH1A1 (0.83) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL31248356 0.82 CYP2C9 (0.67) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL4586604 0.82 KMT2A (0.66) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL23565002 0.82 KMT2A (0.66) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL1709315 0.82 HPGD (0.70) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL7932170 0.82 KMT2A (0.66) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL5392945 0.82 SMN1; SMN2 (0.64) KMT2AMEN1CYP2C9CYP2C19ALDH1A1
SCHEMBL11864632 0.82 HPGD (0.73) KMT2AMEN1CYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP claimed
US-20140371198-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2014-12-18 US disclosed
US-8759334-B2 Compounds useful for the treatment of metabolic and inflammatory diseases GALAPAGOS NV (BE) 2014-06-24 US disclosed
EP-2665704-A1 AZETIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES Galapagos NV (BE) 2013-11-27 EP disclosed
US-20130303515-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2013-11-14 US disclosed
WO-2012098033-A1 AZETIDINE DERIVATIVES USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2012-07-26 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 (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-20140371198-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES GOT2, GPR119, PC KMT2A 3849/4885MEN1 3061/4885CYP2C9 2924/4885
US-20130303515-A1 NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC AND INFLAMMATORY DISEASES GOT2, GPR119, PC KMT2A 3849/4885MEN1 3061/4885CYP2C9 2924/4885

“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.