SCHEMBL16148682

SCHEMBL16148682

O=C(Nc1ccc(Br)cc1Cl)c1cc(Cl)ccc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 5/20 0.66
MEN1 O00255 2/20 0.64
NPC1 O15118 2/20 0.64
ALDH1A1 P00352 2/20 0.64
RAB9A P51151 2/20 0.64
KMT2A Q03164 2/20 0.64
AURKA O14965 1/20 0.64
PDPK1 O15530 1/20 0.64
JAK2 O60674 1/20 0.64
GMNN O75496 1/20 0.64
EGFR P00533 1/20 0.64
LMNA P02545 1/20 0.64
TP53 P04637 1/20 0.64
CYP1A2 P05177 1/20 0.64
LYN P07948 1/20 0.64
CHRM2 P08172 1/20 0.64
CYP3A4 P08684 1/20 0.64
ADRA2A P08913 1/20 0.64
CYP2D6 P10635 1/20 0.64
MAPT P10636 1/20 0.64

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
SCHEMBL17407572 0.93 KMT2A (0.55) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL30771727 0.90 KCNMA1 (0.76) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL15026045 0.90 KCNMA1 (0.76) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL11316628 0.89 KCNMA1 (0.66) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL10138038 0.86 KCNMA1 (0.69) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL28454139 0.85 KCNMA1 (0.69) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL24481190 0.84 KCNMA1 (0.68) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL29617476 0.84 KCNMA1 (0.68) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL11887644 0.84 KCNMA1 (0.68) KCNMA1MEN1NPC1ALDH1A1RAB9A
SCHEMBL11230861 0.83 NPC1 (0.61) KCNMA1MEN1NPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020132700-A1 METHODS OF USING INHIBITORS OF SREBP IN COMBINATION WITH NICLOSAMIDE AND ANALOGS THEREOF Fgh Biotech Inc. (US) 2020-06-25 WO disclosed
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
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 1171/4885NPC1 906/4885
US-20180370905-A1 Compounds Useful for the Treatment of Metabolic Disorders and Synthesis of the Same GLS2, PC, GLS KCNMA1 2695/4885MEN1 1171/4885NPC1 906/4885
US-20160046560-A1 COMPOUNDS USEFUL FOR THE TREATMENT OF METABOLIC DISORDERS AND SYNTHESIS OF THE SAME GLS2, PC, GLS KCNMA1 2695/4885MEN1 1171/4885NPC1 906/4885

“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.