SCHEMBL4012779

SCHEMBL4012779

Cc1ccc(CNC(=O)NCC2CCC(CNS(=O)(=O)c3ccc(C)cc3)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
MEN1 O00255 3/20 0.67
ALDH1A1 P00352 10/20 0.64
CYP2C9 P11712 1/20 0.64
NAMPT P43490 3/20 0.60
PKM P14618 1/20 0.59
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
HPGD P15428 1/20 0.56
POLB P06746 1/20 0.55
MAPK1 P28482 1/20 0.55
USP2 O75604 1/20 0.55
THRB P10828 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL4008674 0.94 MAPT (0.66) KMT2AMEN1ALDH1A1CYP2C9NAMPT
SCHEMBL4004972 0.88 MEN1 (0.61) KMT2AMEN1ALDH1A1CYP2C9NAMPT
SCHEMBL3851498 0.87 KMT2A (0.86) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL4005992 0.87 KMT2A (0.53) KMT2AMEN1ALDH1A1CYP2C9NAMPT
SCHEMBL4009437 0.83 THRB (0.68) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL4006225 0.83 MAPT (0.79) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL3851560 0.81 MEN1 (0.80) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL4014284 0.80 NAMPT (0.59) KMT2AMEN1ALDH1A1NAMPTMAPT
SCHEMBL13796474 0.79 ALDH1A1 (0.64) KMT2AMEN1ALDH1A1CYP2C9PKM
SCHEMBL3853060 0.78 ALDH1A1 (1.00) KMT2AMEN1ALDH1A1CYP2C9PKM

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-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US claimed
US-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ASTRAZENECA AB (SE) 2009-12-10 US disclosed
WO-2009082346-A1 NEW ACETYL COENZYME A CARBOXYLASE (ACC) INHIBITORS AND USES IN TREATMENTS OF OBESITY AND DIABETES MELLITUS - 087 ASTRAZENECA AB (SE) 2009-07-02 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-20090306133-A1 New Acetyl Coenzyme A Carboxylase (ACC) Inhibitors And Uses In Treatments Of Obesity And Diabetes Mellitus - 087 ACACA, ACACB, ACAT1 KMT2A 1754/4885MEN1 4443/4885ALDH1A1 169/4885

“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.