SCHEMBL16148508

SCHEMBL16148508

COc1ccc(Cl)cc1C(=O)Nc1ccc(C(=O)O)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 3/20 0.63
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
PYGL P06737 2/20 0.58
ALDH1A1 P00352 4/20 0.56
HDAC8 Q9BY41 2/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
NPC1 O15118 1/20 0.55
HTT P42858 1/20 0.55
RAB9A P51151 1/20 0.55
KCNH2 Q12809 1/20 0.55
TTR P02766 1/20 0.54
LMNA P02545 1/20 0.53
HPGD P15428 1/20 0.53
MAPT P10636 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51
KDM4E B2RXH2 1/20 0.51
PKM P14618 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
SCHEMBL16147300 0.90 MEN1 (0.71) KCNMA1MEN1KMT2AALDH1A1HDAC8
SCHEMBL16149156 0.88 PYGL (0.54) KCNMA1MEN1KMT2APYGLALDH1A1
SCHEMBL16148611 0.86 NR1H4 (0.60) MEN1KMT2APYGLALDH1A1NPC1
SCHEMBL1353382 0.84 KCNMA1 (0.58) KCNMA1MEN1KMT2APYGLALDH1A1
SCHEMBL30692656 0.83 MEN1 (0.81) KCNMA1MEN1KMT2AALDH1A1HDAC8
SCHEMBL11466437 0.83 MEN1 (0.81) KCNMA1MEN1KMT2AALDH1A1HDAC8
SCHEMBL11594592 0.82 KCNMA1 (0.62) KCNMA1MEN1KMT2APYGLALDH1A1
SCHEMBL22088834 0.82 POLB (0.71) KCNMA1MEN1KMT2AALDH1A1NPC1
SCHEMBL16148208 0.82 KCNMA1 (0.64) KCNMA1MEN1KMT2APYGLALDH1A1
SCHEMBL16147794 0.81 KCNMA1 (0.67) KCNMA1MEN1KMT2APYGLNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180370905-A1 Compounds Useful for the Treatment of Metabolic Disorders and Synthesis of the Same NORTH CAROLINA CENTRAL UNIV (US) 2018-12-27 US disclosed
US-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same NORTH CAROLINA CENTRAL UNIVERSITY (US) 2018-06-26 US disclosed
US-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same NORTH CAROLINA CENTRAL UNIVERSITY (US) 2018-06-26 US disclosed
US-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same NORTH CAROLINA CENTRAL UNIVERSITY (US) 2018-06-26 US disclosed
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY 2016-02-18 US disclosed
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY 2016-02-18 US disclosed
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY 2016-02-18 US disclosed
WO-2014165816-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME NORTH CAROLINA CENTRAL UNIVERSITY (US) 2014-10-09 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 (3 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-10005720-B2 Compounds useful for the treatment of metabolic disorders and synthesis of the same GLS2, PC, GLS KCNMA1 2695/4885MEN1 1171/4885KMT2A 1812/4885
US-20180370905-A1 Compounds Useful for the Treatment of Metabolic Disorders and Synthesis of the Same GLS2, PC, GLS KCNMA1 2695/4885MEN1 1171/4885KMT2A 1812/4885
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME GLS2, PC, GLS KCNMA1 2695/4885MEN1 1171/4885KMT2A 1812/4885

“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.